3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride

C18H29ClN2O — CID 119802836

IUPAC3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride
SMILESCCCC(CCc1ccccc1)NC(=O)C1CCC(N)C1.Cl
InChIInChI=1S/C18H28N2O.ClH/c1-2-6-17(12-9-14-7-4-3-5-8-14)20-18(21)15-10-11-16(19)13-15;/h3-5,7-8,15-17H,2,6,9-13,19H2,1H3,(H,20,21);1H
InChIKeyOQJCIEUYTMQLQJ-UHFFFAOYSA-N
MW324.90 g/mol
LogP3.45
Rot. Bonds7

About 3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride

3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride (PubChem CID 119802836) has the molecular formula C18H29ClN2O and a molecular weight of 324.90 g/mol. Its IUPAC name is 3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride
PubChem CID119802836
Molecular FormulaC18H29ClN2O
Molecular Weight324.90 g/mol
Exact Mass324.20
IUPAC Name3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride
SMILESCCCC(CCc1ccccc1)NC(=O)C1CCC(N)C1.Cl
InChIInChI=1S/C18H28N2O.ClH/c1-2-6-17(12-9-14-7-4-3-5-8-14)20-18(21)15-10-11-16(19)13-15;/h3-5,7-8,15-17H,2,6,9-13,19H2,1H3,(H,20,21);1H
InChIKeyOQJCIEUYTMQLQJ-UHFFFAOYSA-N
XLogP3.45
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.90
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride 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

(2S,4S)-2-methyl-N-(1-phenylhexan-3-yl)piperidine-4-carboxamide
CID 120635934
N-(1-phenylhexan-3-yl)piperidine-4-carboxamide
CID 119334584
N-(1-phenylhexan-3-yl)pyrrolidine-3-carboxamide
CID 119802857
2-(cyclopropylmethylamino)-N-(1-phenylhexan-3-yl)acetamide
CID 119802845
methyl 2-[(3-aminocyclopentanecarbonyl)amino]-3-phenylpropanoate;hydrochloride
CID 119726356
N-[(2S)-4-phenylbutan-2-yl]cyclopropanecarboxamide
CID 844321
3-amino-N-(2-ethyl-1-phenylbutyl)cyclopentane-1-carboxamide
CID 66007495
3-amino-N-[2-methyl-1-(4-propylphenyl)propyl]cyclopentane-1-carboxamide
CID 119692874
N-(1,5-diphenylpentan-3-yl)pyrrolidine-3-carboxamide;hydrochloride
CID 119813623
3-amino-N-[[1-(2-phenylethyl)pyrrolidin-3-yl]methyl]cyclopentane-1-carboxamide;dihydrochloride
CID 119866949
4,4-difluoro-2-methyl-N-(1-phenylhexan-3-yl)butanamide
CID 167903936
3-amino-N-[2-(4-ethylphenyl)ethyl]cyclopentane-1-carboxamide
CID 119760925

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride?
The IUPAC name of 3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride (CID 119802836) is 3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride.
What is the SMILES notation for 3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride?
The canonical SMILES for 3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride is CCCC(CCc1ccccc1)NC(=O)C1CCC(N)C1.Cl.
What is the InChIKey of 3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride?
The InChIKey is OQJCIEUYTMQLQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O.ClH/c1-2-6-17(12-9-14-7-4-3-5-8-14)20-18(21)15-10-11-16(19)13-15;/h3-5,7-8,15-17H,2,6,9-13,19H2,1H3,(H,20,21);1H.
What are the key properties of 3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride?
3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride has a molecular weight of 324.90 g/mol, XLogP of 3.45, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-phenylhexan-3-yl)cyclopentane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119802836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).