(3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide

C19H26N4O — CID 126437006

IUPAC(3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide
SMILESCc1ccc(CCCNC(=O)N2CCC[C@@H](c3ncc[nH]3)C2)cc1
InChIInChI=1S/C19H26N4O/c1-15-6-8-16(9-7-15)4-2-10-22-19(24)23-13-3-5-17(14-23)18-20-11-12-21-18/h6-9,11-12,17H,2-5,10,13-14H2,1H3,(H,20,21)(H,22,24)/t17-/m1/s1
InChIKeyRSODCTBFMODVMS-QGZVFWFLSA-N
MW326.44 g/mol
LogP3.24
Rot. Bonds5

About (3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide

(3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide (PubChem CID 126437006) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is (3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name(3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide
PubChem CID126437006
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC Name(3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide
SMILESCc1ccc(CCCNC(=O)N2CCC[C@@H](c3ncc[nH]3)C2)cc1
InChIInChI=1S/C19H26N4O/c1-15-6-8-16(9-7-15)4-2-10-22-19(24)23-13-3-5-17(14-23)18-20-11-12-21-18/h6-9,11-12,17H,2-5,10,13-14H2,1H3,(H,20,21)(H,22,24)/t17-/m1/s1
InChIKeyRSODCTBFMODVMS-QGZVFWFLSA-N
XLogP3.24
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze (3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide 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

N-[3-(furan-2-yl)propyl]-3-(1H-imidazol-2-yl)piperidine-1-carboxamide
CID 122562007
(3S)-3-(1H-imidazol-2-yl)-N-[(2S)-2-(4-methylphenoxy)propyl]piperidine-1-carboxamide
CID 95968600
(3R)-N-[2-(2,5-difluorophenyl)ethyl]-3-(1H-imidazol-2-yl)piperidine-1-carboxamide
CID 97319285
N-[2-(4-ethylphenyl)-2-methylpropyl]-3-(1H-imidazol-2-yl)piperidine-1-carboxamide
CID 136513087
formic acid;3-(1H-imidazol-2-yl)-N-[2-(2-methyl-1,2,4-triazol-3-yl)ethyl]piperidine-1-carboxamide
CID 154907745
3-(1H-imidazol-2-yl)-N-[[6-(4-methylpiperazin-1-yl)-3-pyridinyl]methyl]piperidine-1-carboxamide
CID 166188674
3-(1H-imidazol-2-yl)piperidine-1-carboxylic acid
CID 90026172
(3R)-3-(1H-imidazol-2-yl)-N-[2-(1-methyltetrazol-5-yl)sulfanylethyl]piperidine-1-carboxamide
CID 126451352
3-(1H-imidazol-2-yl)-N-[(3-methoxy-2-methylphenyl)methyl]piperidine-1-carboxamide
CID 136553406
(3S)-3-(1H-imidazol-2-yl)-N-[(2R)-2-phenylsulfanylpropyl]piperidine-1-carboxamide
CID 95968867
(3S)-3-(1H-imidazol-2-yl)-N-[(2R)-2-methyl-3-thiophen-2-ylpropyl]piperidine-1-carboxamide
CID 95967517
(3R)-3-(6-oxo-1H-pyrimidin-4-yl)-N-[3-(4-propan-2-ylphenyl)propyl]piperidine-1-carboxamide
CID 137043793

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide?
The IUPAC name of (3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide (CID 126437006) is (3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide.
What is the SMILES notation for (3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide?
The canonical SMILES for (3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide is Cc1ccc(CCCNC(=O)N2CCC[C@@H](c3ncc[nH]3)C2)cc1.
What is the InChIKey of (3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide?
The InChIKey is RSODCTBFMODVMS-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H26N4O/c1-15-6-8-16(9-7-15)4-2-10-22-19(24)23-13-3-5-17(14-23)18-20-11-12-21-18/h6-9,11-12,17H,2-5,10,13-14H2,1H3,(H,20,21)(H,22,24)/t17-/m1/s1.
What are the key properties of (3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide?
(3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide has a molecular weight of 326.44 g/mol, XLogP of 3.24, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(1H-imidazol-2-yl)-N-[3-(4-methylphenyl)propyl]piperidine-1-carboxamide is sourced from PubChem (CID 126437006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).