N,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride

C21H26ClN3O2 — CID 119780429

IUPACN,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride
SMILESCl.O=C(CC1CCCN1)NC(Cc1ccccc1)C(=O)Nc1ccccc1
InChIInChI=1S/C21H25N3O2.ClH/c25-20(15-18-12-7-13-22-18)24-19(14-16-8-3-1-4-9-16)21(26)23-17-10-5-2-6-11-17;/h1-6,8-11,18-19,22H,7,12-15H2,(H,23,26)(H,24,25);1H
InChIKeyKJLSIBBXQDATEU-UHFFFAOYSA-N
MW387.91 g/mol
LogP2.92
Rot. Bonds7

About N,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride

N,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride (PubChem CID 119780429) has the molecular formula C21H26ClN3O2 and a molecular weight of 387.91 g/mol. Its IUPAC name is N,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride.

Molecular Properties

Compound NameN,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride
PubChem CID119780429
Molecular FormulaC21H26ClN3O2
Molecular Weight387.91 g/mol
Exact Mass387.17
IUPAC NameN,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride
SMILESCl.O=C(CC1CCCN1)NC(Cc1ccccc1)C(=O)Nc1ccccc1
InChIInChI=1S/C21H25N3O2.ClH/c25-20(15-18-12-7-13-22-18)24-19(14-16-8-3-1-4-9-16)21(26)23-17-10-5-2-6-11-17;/h1-6,8-11,18-19,22H,7,12-15H2,(H,23,26)(H,24,25);1H
InChIKeyKJLSIBBXQDATEU-UHFFFAOYSA-N
XLogP2.92
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.91
LogP ≤ 52.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;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

N-[1-(dimethylamino)-3-phenylpropan-2-yl]-2-pyrrolidin-2-ylacetamide
CID 119859537
2-methyl-N-[3-[(2-pyrrolidin-2-ylacetyl)amino]phenyl]propanamide
CID 61366011
N-phenyl-4-[(2-pyrrolidin-2-ylacetyl)amino]benzamide
CID 119756453
N-(2,3-diphenylpropyl)-2-pyrrolidin-2-ylacetamide
CID 119803974
2-[4-[(2-pyrrolidin-2-ylacetyl)amino]phenyl]acetic acid
CID 61366052
2-[(2-pyrrolidin-2-ylacetyl)amino]-N-(3-pyrrolidin-1-ylphenyl)pentanamide
CID 119872875
N-(3-phenoxyphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119673254
N-[(1R)-2-hydroxy-1-phenylethyl]-2-pyrrolidin-2-ylacetamide
CID 114010293
(2S)-2-benzyl-3-[(2S)-pyrrolidin-2-yl]propanoic acid
CID 11470323
N-[1-(4-phenylphenyl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 119685566
N-[1-(2-fluorophenyl)propan-2-yl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119722793
N-(3-methylphenyl)-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119670441

Frequently Asked Questions

What is the IUPAC name of N,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride?
The IUPAC name of N,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride (CID 119780429) is N,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride.
What is the SMILES notation for N,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride?
The canonical SMILES for N,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride is Cl.O=C(CC1CCCN1)NC(Cc1ccccc1)C(=O)Nc1ccccc1.
What is the InChIKey of N,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride?
The InChIKey is KJLSIBBXQDATEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O2.ClH/c25-20(15-18-12-7-13-22-18)24-19(14-16-8-3-1-4-9-16)21(26)23-17-10-5-2-6-11-17;/h1-6,8-11,18-19,22H,7,12-15H2,(H,23,26)(H,24,25);1H.
What are the key properties of N,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride?
N,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride has a molecular weight of 387.91 g/mol, XLogP of 2.92, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-diphenyl-2-[(2-pyrrolidin-2-ylacetyl)amino]propanamide;hydrochloride is sourced from PubChem (CID 119780429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).