N-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide

C22H35N3O2 — CID 78792835

IUPACN-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide
SMILESCC(C(=O)N(C)C1CCCCC1)N1CCN(CCOc2ccccc2)CC1
InChIInChI=1S/C22H35N3O2/c1-19(22(26)23(2)20-9-5-3-6-10-20)25-15-13-24(14-16-25)17-18-27-21-11-7-4-8-12-21/h4,7-8,11-12,19-20H,3,5-6,9-10,13-18H2,1-2H3
InChIKeyBTLBYPALOALNML-UHFFFAOYSA-N
MW373.54 g/mol
LogP2.86
Rot. Bonds7

About N-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide

N-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide (PubChem CID 78792835) has the molecular formula C22H35N3O2 and a molecular weight of 373.54 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide
PubChem CID78792835
Molecular FormulaC22H35N3O2
Molecular Weight373.54 g/mol
Exact Mass373.27
IUPAC NameN-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide
SMILESCC(C(=O)N(C)C1CCCCC1)N1CCN(CCOc2ccccc2)CC1
InChIInChI=1S/C22H35N3O2/c1-19(22(26)23(2)20-9-5-3-6-10-20)25-15-13-24(14-16-25)17-18-27-21-11-7-4-8-12-21/h4,7-8,11-12,19-20H,3,5-6,9-10,13-18H2,1-2H3
InChIKeyBTLBYPALOALNML-UHFFFAOYSA-N
XLogP2.86
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.54
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide 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

(2R)-2-[4-(2-phenoxyethyl)piperazin-1-yl]-N-propan-2-ylpropanamide
CID 9348561
(2R)-2-[4-(2-phenoxyethyl)piperazin-1-yl]-N-phenylpropanamide
CID 9259510
N-cyclohexyl-2-[4-(2-hydroxyphenyl)piperazin-1-yl]-N-methylpropanamide
CID 78786222
(2S)-2-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-N-cyclohexyl-N-methylpropanamide
CID 9357237
(2S)-N-cyclohexyl-2-[4-[2-(2-ethylanilino)-2-oxoethyl]piperazin-1-yl]-N-methylpropanamide
CID 30622887
(2R)-2-[4-[2-(2-chloroanilino)-2-oxoethyl]piperazin-1-yl]-N-cyclohexyl-N-methylpropanamide
CID 30620317
N'-hydroxy-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanimidamide
CID 77012516
(2R)-N-cyclohexyl-2-[4-[2-(4-fluoroanilino)-2-oxoethyl]piperazin-1-yl]-N-methylpropanamide
CID 30621428
N,N-dimethyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]acetamide
CID 78792872
2-[4-(2-phenoxyethyl)piperazin-1-yl]-N-(2,4,6-trimethylphenyl)propanamide
CID 84965791
2-[4-(2-phenoxyethyl)piperazin-1-yl]-N-[4-(trifluoromethoxy)phenyl]propanamide
CID 55370406
(2R)-2-[4-(2-phenoxyethyl)piperazin-1-yl]-N-(2,4,5-trichlorophenyl)propanamide
CID 30635620

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide?
The IUPAC name of N-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide (CID 78792835) is N-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide?
The canonical SMILES for N-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide is CC(C(=O)N(C)C1CCCCC1)N1CCN(CCOc2ccccc2)CC1.
What is the InChIKey of N-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide?
The InChIKey is BTLBYPALOALNML-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H35N3O2/c1-19(22(26)23(2)20-9-5-3-6-10-20)25-15-13-24(14-16-25)17-18-27-21-11-7-4-8-12-21/h4,7-8,11-12,19-20H,3,5-6,9-10,13-18H2,1-2H3.
What are the key properties of N-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide?
N-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide has a molecular weight of 373.54 g/mol, XLogP of 2.86, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-2-[4-(2-phenoxyethyl)piperazin-1-yl]propanamide is sourced from PubChem (CID 78792835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).