[4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone

C19H23N5O — CID 53184227

IUPAC[4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone
SMILESCc1ccccc1C(=O)N1CCN(C2=CC3=NCC(C)N3C=N2)CC1
InChIInChI=1S/C19H23N5O/c1-14-5-3-4-6-16(14)19(25)23-9-7-22(8-10-23)17-11-18-20-12-15(2)24(18)13-21-17/h3-6,11,13,15H,7-10,12H2,1-2H3
InChIKeyJZPYMJBXSOJBTF-UHFFFAOYSA-N
MW337.43 g/mol
LogP1.74
Rot. Bonds2

About [4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone

[4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone (PubChem CID 53184227) has the molecular formula C19H23N5O and a molecular weight of 337.43 g/mol. Its IUPAC name is [4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone.

Molecular Properties

Compound Name[4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone
PubChem CID53184227
Molecular FormulaC19H23N5O
Molecular Weight337.43 g/mol
Exact Mass337.19
IUPAC Name[4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone
SMILESCc1ccccc1C(=O)N1CCN(C2=CC3=NCC(C)N3C=N2)CC1
InChIInChI=1S/C19H23N5O/c1-14-5-3-4-6-16(14)19(25)23-9-7-22(8-10-23)17-11-18-20-12-15(2)24(18)13-21-17/h3-6,11,13,15H,7-10,12H2,1-2H3
InChIKeyJZPYMJBXSOJBTF-UHFFFAOYSA-N
XLogP1.74
TPSA51.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[4-(2-bromophenyl)piperazin-1-yl]-(2-methylphenyl)methanone
CID 113079338
(2-methylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 896524
azepan-1-yl-(2-methylphenyl)methanone
CID 4616576
(2-methylphenyl)-(4-methylpiperazin-1-yl)methanone
CID 904148
(2-methylphenyl)-[4-(6-morpholin-4-ylpyridazin-3-yl)piperazin-1-yl]methanone
CID 7292470
[4-(2,3-dimethylphenyl)piperazin-1-yl]-(2-methylphenyl)methanone
CID 673636
[4-(4-hydroxyphenyl)piperazin-1-yl]-(2-methylphenyl)methanone
CID 78777425
(2-bromophenyl)-[4-(2-methylphenyl)piperazin-1-yl]methanone
CID 17249489
[4-(2-fluorophenyl)piperazin-1-yl]-(2-methylphenyl)methanone
CID 808454
[4-(9H-fluoren-9-yl)piperazin-1-yl]-(2-methylphenyl)methanone
CID 118725821
[4-(3,5-dimethyl-2-pyridinyl)piperazin-1-yl]-(2-methylphenyl)methanone
CID 141265306
2-[4-(2-methylbenzoyl)piperazin-1-yl]benzonitrile
CID 113080800

Frequently Asked Questions

What is the IUPAC name of [4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone?
The IUPAC name of [4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone (CID 53184227) is [4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone.
What is the SMILES notation for [4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone?
The canonical SMILES for [4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone is Cc1ccccc1C(=O)N1CCN(C2=CC3=NCC(C)N3C=N2)CC1.
What is the InChIKey of [4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone?
The InChIKey is JZPYMJBXSOJBTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O/c1-14-5-3-4-6-16(14)19(25)23-9-7-22(8-10-23)17-11-18-20-12-15(2)24(18)13-21-17/h3-6,11,13,15H,7-10,12H2,1-2H3.
What are the key properties of [4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone?
[4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone has a molecular weight of 337.43 g/mol, XLogP of 1.74, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3-methyl-2,3-dihydroimidazo[1,2-c]pyrimidin-7-yl)piperazin-1-yl]-(2-methylphenyl)methanone is sourced from PubChem (CID 53184227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).