(2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide

C16H27N3O2 — CID 126448035

IUPAC(2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide
SMILESCc1nccn1[C@H](C)C(=O)NCCCOC1CCCCC1
InChIInChI=1S/C16H27N3O2/c1-13(19-11-10-17-14(19)2)16(20)18-9-6-12-21-15-7-4-3-5-8-15/h10-11,13,15H,3-9,12H2,1-2H3,(H,18,20)/t13-/m1/s1
InChIKeyPSXQWSGIEVEQEK-CYBMUJFWSA-N
MW293.41 g/mol
LogP2.61
Rot. Bonds7

About (2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide

(2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide (PubChem CID 126448035) has the molecular formula C16H27N3O2 and a molecular weight of 293.41 g/mol. Its IUPAC name is (2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide.

Molecular Properties

Compound Name(2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide
PubChem CID126448035
Molecular FormulaC16H27N3O2
Molecular Weight293.41 g/mol
Exact Mass293.21
IUPAC Name(2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide
SMILESCc1nccn1[C@H](C)C(=O)NCCCOC1CCCCC1
InChIInChI=1S/C16H27N3O2/c1-13(19-11-10-17-14(19)2)16(20)18-9-6-12-21-15-7-4-3-5-8-15/h10-11,13,15H,3-9,12H2,1-2H3,(H,18,20)/t13-/m1/s1
InChIKeyPSXQWSGIEVEQEK-CYBMUJFWSA-N
XLogP2.61
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-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

N-[2-(azepan-1-yl)ethyl]-2-(2-methylimidazol-1-yl)propanamide
CID 119069534
2-amino-N-(3-cyclohexyloxypropyl)propanamide
CID 61275790
2-(2-methylimidazol-1-yl)-N-propan-2-ylpropanamide
CID 63810179
2-amino-N-(3-cyclohexyloxypropyl)-2-(4-methylphenyl)acetamide
CID 120666811
N-[3-(4-aminocyclohexyl)oxypropyl]-2-pyrazol-1-ylpropanamide
CID 63870310
N-[[1-(methoxymethyl)cyclobutyl]methyl]-2-(2-methylimidazol-1-yl)propanamide
CID 119071530
1-(3-cyclohexyloxypropyl)-3-(2-propan-2-yloxy-3-pyridinyl)urea
CID 112834635
N-(3-cyclohexyloxypropyl)-3-methylimidazole-4-carboxamide
CID 122562458
1-(3-cyclohexyloxypropyl)-3-[3-(3,5-dimethylpyrazol-1-yl)propyl]urea
CID 86993142
N-(3-cyclohexyloxypropyl)-4-propan-2-ylbenzamide
CID 134029978
N-(3-cyclohexyloxypropyl)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanamide
CID 46613224
N-(3-cyclohexyloxypropyl)-3-(difluoromethyl)-1-methylpyrazole-5-carboxamide
CID 122562455

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide?
The IUPAC name of (2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide (CID 126448035) is (2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide.
What is the SMILES notation for (2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide?
The canonical SMILES for (2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide is Cc1nccn1[C@H](C)C(=O)NCCCOC1CCCCC1.
What is the InChIKey of (2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide?
The InChIKey is PSXQWSGIEVEQEK-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H27N3O2/c1-13(19-11-10-17-14(19)2)16(20)18-9-6-12-21-15-7-4-3-5-8-15/h10-11,13,15H,3-9,12H2,1-2H3,(H,18,20)/t13-/m1/s1.
What are the key properties of (2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide?
(2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide has a molecular weight of 293.41 g/mol, XLogP of 2.61, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-cyclohexyloxypropyl)-2-(2-methylimidazol-1-yl)propanamide is sourced from PubChem (CID 126448035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).