1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one

C159H210F4N32O12 — CID 158071294

IUPAC1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one
SMILESCc1ccc(N2CCCCC2)cc1.Cc1ccc(N2CCCCC2)cc1F.Cc1ccc(N2CCCCC2)cn1.Cc1ccc(N2CCCNC2)cc1.Cc1ccc(N2CCCNC2)cc1F.Cc1ccc(N2CCCNC2)cn1.Cc1ccc(N2CCNCC2=O)cc1.Cc1ccc(N2CCNCC2=O)cc1F.Cc1ccc(N2CCNCC2=O)cn1.Cc1ccc(N2CCOCC2=O)cc1.Cc1ccc(N2CCOCC2=O)cc1F.Cc1ccc(N2CCOCC2=O)cn1.Cc1ncc(N2CCCCC2)cn1.Cc1ncc(N2CCNCC2=O)cn1.Cc1ncc(N2CCOCC2=O)cn1
InChIInChI=1S/C12H16FN.C12H17N.C11H13FN2O.C11H15FN2.C11H12FNO2.C11H14N2O.2C11H16N2.C11H13NO2.C10H13N3O.2C10H15N3.C10H12N2O2.C9H12N4O.C9H11N3O2/c1-10-5-6-11(9-12(10)13)14-7-3-2-4-8-14;1-11-5-7-12(8-6-11)13-9-3-2-4-10-13;1-8-2-3-9(6-10(8)12)14-5-4-13-7-11(14)15;1-9-3-4-10(7-11(9)12)14-6-2-5-13-8-14;1-8-2-3-9(6-10(8)12)13-4-5-15-7-11(13)14;1-9-2-4-10(5-3-9)13-7-6-12-8-11(13)14;1-10-3-5-11(6-4-10)13-8-2-7-12-9-13;1-10-5-6-11(9-12-10)13-7-3-2-4-8-13;1-9-2-4-10(5-3-9)12-6-7-14-8-11(12)13;1-8-2-3-9(6-12-8)13-5-4-11-7-10(13)14;1-9-3-4-10(7-12-9)13-6-2-5-11-8-13;1-9-11-7-10(8-12-9)13-5-3-2-4-6-13;1-8-2-3-9(6-11-8)12-4-5-14-7-10(12)13;1-7-11-4-8(5-12-7)13-3-2-10-6-9(13)14;1-7-10-4-8(5-11-7)12-2-3-14-6-9(12)13/h5-6,9H,2-4,7-8H2,1H3;5-8H,2-4,9-10H2,1H3;2-3,6,13H,4-5,7H2,1H3;3-4,7,13H,2,5-6,8H2,1H3;2-3,6H,4-5,7H2,1H3;2-5,12H,6-8H2,1H3;3-6,12H,2,7-9H2,1H3;5-6,9H,2-4,7-8H2,1H3;2-5H,6-8H2,1H3;2-3,6,11H,4-5,7H2,1H3;3-4,7,11H,2,5-6,8H2,1H3;7-8H,2-6H2,1H3;2-3,6H,4-5,7H2,1H3;4-5,10H,2-3,6H2,1H3;4-5H,2-3,6H2,1H3
InChIKeyFLVUJJPHAQCTLQ-UHFFFAOYSA-N
MW2837.63 g/mol
LogP20.86
Rot. Bonds15

About 1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one

1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one (PubChem CID 158071294) has the molecular formula C159H210F4N32O12 and a molecular weight of 2837.63 g/mol. Its IUPAC name is 1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one.

Molecular Properties

Compound Name1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one
PubChem CID158071294
Molecular FormulaC159H210F4N32O12
Molecular Weight2837.63 g/mol
Exact Mass2835.67
IUPAC Name1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one
SMILESCc1ccc(N2CCCCC2)cc1.Cc1ccc(N2CCCCC2)cc1F.Cc1ccc(N2CCCCC2)cn1.Cc1ccc(N2CCCNC2)cc1.Cc1ccc(N2CCCNC2)cc1F.Cc1ccc(N2CCCNC2)cn1.Cc1ccc(N2CCNCC2=O)cc1.Cc1ccc(N2CCNCC2=O)cc1F.Cc1ccc(N2CCNCC2=O)cn1.Cc1ccc(N2CCOCC2=O)cc1.Cc1ccc(N2CCOCC2=O)cc1F.Cc1ccc(N2CCOCC2=O)cn1.Cc1ncc(N2CCCCC2)cn1.Cc1ncc(N2CCNCC2=O)cn1.Cc1ncc(N2CCOCC2=O)cn1
InChIInChI=1S/C12H16FN.C12H17N.C11H13FN2O.C11H15FN2.C11H12FNO2.C11H14N2O.2C11H16N2.C11H13NO2.C10H13N3O.2C10H15N3.C10H12N2O2.C9H12N4O.C9H11N3O2/c1-10-5-6-11(9-12(10)13)14-7-3-2-4-8-14;1-11-5-7-12(8-6-11)13-9-3-2-4-10-13;1-8-2-3-9(6-10(8)12)14-5-4-13-7-11(14)15;1-9-3-4-10(7-11(9)12)14-6-2-5-13-8-14;1-8-2-3-9(6-10(8)12)13-4-5-15-7-11(13)14;1-9-2-4-10(5-3-9)13-7-6-12-8-11(13)14;1-10-3-5-11(6-4-10)13-8-2-7-12-9-13;1-10-5-6-11(9-12-10)13-7-3-2-4-8-13;1-9-2-4-10(5-3-9)12-6-7-14-8-11(12)13;1-8-2-3-9(6-12-8)13-5-4-11-7-10(13)14;1-9-3-4-10(7-12-9)13-6-2-5-11-8-13;1-9-11-7-10(8-12-9)13-5-3-2-4-6-13;1-8-2-3-9(6-11-8)12-4-5-14-7-10(12)13;1-7-11-4-8(5-12-7)13-3-2-10-6-9(13)14;1-7-10-4-8(5-11-7)12-2-3-14-6-9(12)13/h5-6,9H,2-4,7-8H2,1H3;5-8H,2-4,9-10H2,1H3;2-3,6,13H,4-5,7H2,1H3;3-4,7,13H,2,5-6,8H2,1H3;2-3,6H,4-5,7H2,1H3;2-5,12H,6-8H2,1H3;3-6,12H,2,7-9H2,1H3;5-6,9H,2-4,7-8H2,1H3;2-5H,6-8H2,1H3;2-3,6,11H,4-5,7H2,1H3;3-4,7,11H,2,5-6,8H2,1H3;7-8H,2-6H2,1H3;2-3,6H,4-5,7H2,1H3;4-5,10H,2-3,6H2,1H3;4-5H,2-3,6H2,1H3
InChIKeyFLVUJJPHAQCTLQ-UHFFFAOYSA-N
XLogP20.86
TPSA435.19 Ų
H-Bond Donors7
H-Bond Acceptors36
Rotatable Bonds15
Heavy Atoms207
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002837.63
LogP ≤ 520.86
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

Analyze 1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-ethyl-3-[4-(4-morpholin-4-yl-6-pyrazin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl)phenyl]urea
CID 59239188
1-ethyl-3-[4-[7-(5-fluoropyrimidin-2-yl)-4-[(3S)-3-methylmorpholin-4-yl]-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]phenyl]urea
CID 67178880
1-ethyl-3-[4-[7-(5-fluoropyrimidin-2-yl)-4-morpholin-4-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]phenyl]urea
CID 44816807
1-[5-[[7-[3,5-Difluoro-4-(morpholin-4-ylmethyl)phenyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]-2-pyridinyl]-4-methylpiperazin-2-one
CID 57820160
1-[5-[[7-[3,5-Difluoro-4-(morpholin-4-ylmethyl)phenyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]-2-pyridinyl]piperazin-2-one
CID 57820171
1-[5-[[7-[3,5-Difluoro-4-(morpholin-4-ylmethyl)phenyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]-2-pyridinyl]-3,3-dimethylpiperazin-2-one
CID 57820183
1-[5-[[7-[3,5-Difluoro-4-(morpholin-4-ylmethyl)phenyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]-3-methyl-2-pyridinyl]piperazin-2-one
CID 57820200
1-[5-[[7-[3,5-Difluoro-4-(morpholin-4-ylmethyl)phenyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]-3-methyl-2-pyridinyl]-3,3-dimethylpiperazin-2-one
CID 57820215
1-[4-[[7-[3,5-Difluoro-4-(morpholin-4-ylmethyl)phenyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]-2-pyridinyl]-3,3-dimethylpiperazin-2-one
CID 57820224
4-[[5-[[7-[3,5-Difluoro-4-(morpholin-4-ylmethyl)phenyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]-2-pyridinyl]methyl]-1-methylpiperazin-2-one
CID 57820255
4-[4-[[7-[3,5-Difluoro-4-(morpholin-4-ylmethyl)phenyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]-2-pyridinyl]-1-methylpiperazin-2-one
CID 57820326
1-[[4-[[7-[3,5-Difluoro-4-(morpholin-4-ylmethyl)phenyl]pyrrolo[2,3-d]pyrimidin-2-yl]amino]-2-pyridinyl]methyl]piperazin-2-one
CID 57820403

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one?
The IUPAC name of 1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one (CID 158071294) is 1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one.
What is the SMILES notation for 1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one?
The canonical SMILES for 1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one is Cc1ccc(N2CCCCC2)cc1.Cc1ccc(N2CCCCC2)cc1F.Cc1ccc(N2CCCCC2)cn1.Cc1ccc(N2CCCNC2)cc1.Cc1ccc(N2CCCNC2)cc1F.Cc1ccc(N2CCCNC2)cn1.Cc1ccc(N2CCNCC2=O)cc1.Cc1ccc(N2CCNCC2=O)cc1F.Cc1ccc(N2CCNCC2=O)cn1.Cc1ccc(N2CCOCC2=O)cc1.Cc1ccc(N2CCOCC2=O)cc1F.Cc1ccc(N2CCOCC2=O)cn1.Cc1ncc(N2CCCCC2)cn1.Cc1ncc(N2CCNCC2=O)cn1.Cc1ncc(N2CCOCC2=O)cn1.
What is the InChIKey of 1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one?
The InChIKey is FLVUJJPHAQCTLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FN.C12H17N.C11H13FN2O.C11H15FN2.C11H12FNO2.C11H14N2O.2C11H16N2.C11H13NO2.C10H13N3O.2C10H15N3.C10H12N2O2.C9H12N4O.C9H11N3O2/c1-10-5-6-11(9-12(10)13)14-7-3-2-4-8-14;1-11-5-7-12(8-6-11)13-9-3-2-4-10-13;1-8-2-3-9(6-10(8)12)14-5-4-13-7-11(14)15;1-9-3-4-10(7-11(9)12)14-6-2-5-13-8-14;1-8-2-3-9(6-10(8)12)13-4-5-15-7-11(13)14;1-9-2-4-10(5-3-9)13-7-6-12-8-11(13)14;1-10-3-5-11(6-4-10)13-8-2-7-12-9-13;1-10-5-6-11(9-12-10)13-7-3-2-4-8-13;1-9-2-4-10(5-3-9)12-6-7-14-8-11(12)13;1-8-2-3-9(6-12-8)13-5-4-11-7-10(13)14;1-9-3-4-10(7-12-9)13-6-2-5-11-8-13;1-9-11-7-10(8-12-9)13-5-3-2-4-6-13;1-8-2-3-9(6-11-8)12-4-5-14-7-10(12)13;1-7-11-4-8(5-12-7)13-3-2-10-6-9(13)14;1-7-10-4-8(5-11-7)12-2-3-14-6-9(12)13/h5-6,9H,2-4,7-8H2,1H3;5-8H,2-4,9-10H2,1H3;2-3,6,13H,4-5,7H2,1H3;3-4,7,13H,2,5-6,8H2,1H3;2-3,6H,4-5,7H2,1H3;2-5,12H,6-8H2,1H3;3-6,12H,2,7-9H2,1H3;5-6,9H,2-4,7-8H2,1H3;2-5H,6-8H2,1H3;2-3,6,11H,4-5,7H2,1H3;3-4,7,11H,2,5-6,8H2,1H3;7-8H,2-6H2,1H3;2-3,6H,4-5,7H2,1H3;4-5,10H,2-3,6H2,1H3;4-5H,2-3,6H2,1H3.
What are the key properties of 1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one?
1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one has a molecular weight of 2837.63 g/mol, XLogP of 20.86, 15 rotatable bonds, 7 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-4-methylphenyl)-1,3-diazinane;4-(3-fluoro-4-methylphenyl)morpholin-3-one;1-(3-fluoro-4-methylphenyl)piperazin-2-one;1-(3-fluoro-4-methylphenyl)piperidine;1-(4-methylphenyl)-1,3-diazinane;4-(4-methylphenyl)morpholin-3-one;1-(4-methylphenyl)piperazin-2-one;1-(4-methylphenyl)piperidine;2-methyl-5-piperidin-1-ylpyridine;2-methyl-5-piperidin-1-ylpyrimidine;1-(6-methyl-3-pyridinyl)-1,3-diazinane;4-(6-methyl-3-pyridinyl)morpholin-3-one;1-(6-methyl-3-pyridinyl)piperazin-2-one;4-(2-methylpyrimidin-5-yl)morpholin-3-one;1-(2-methylpyrimidin-5-yl)piperazin-2-one is sourced from PubChem (CID 158071294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).