N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide

C16H24N2O2 — CID 106974225

IUPACN-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)NCC(O)c2ccccc2)CCCN1
InChIInChI=1S/C16H24N2O2/c1-2-9-16(10-6-11-18-16)15(20)17-12-14(19)13-7-4-3-5-8-13/h3-5,7-8,14,18-19H,2,6,9-12H2,1H3,(H,17,20)
InChIKeyFYAIKAXCRFOZNR-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.76
Rot. Bonds6

About N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide

N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide (PubChem CID 106974225) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide
PubChem CID106974225
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)NCC(O)c2ccccc2)CCCN1
InChIInChI=1S/C16H24N2O2/c1-2-9-16(10-6-11-18-16)15(20)17-12-14(19)13-7-4-3-5-8-13/h3-5,7-8,14,18-19H,2,6,9-12H2,1H3,(H,17,20)
InChIKeyFYAIKAXCRFOZNR-UHFFFAOYSA-N
XLogP1.76
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-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-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide
CID 106974945
N-(2-hydroxy-2-phenylethyl)-4-propylpiperidine-4-carboxamide
CID 63127671
N-(2,2-dimethoxyethyl)-2-propylpyrrolidine-2-carboxamide
CID 106974916
N-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide
CID 106975317
N-[(3-cyanophenyl)methyl]-2-propylpyrrolidine-2-carboxamide
CID 106974506
4-[[(2-propylpyrrolidine-2-carbonyl)amino]methyl]benzoic acid
CID 106974808
N-(2-ethylsulfanylphenyl)-2-propylpyrrolidine-2-carboxamide
CID 106974526
N-[(4-fluorophenyl)methyl]-2-propylpyrrolidine-2-carboxamide
CID 106974072
N-(2-hydroxy-2-phenylethyl)-9-propylfluorene-9-carboxamide
CID 22891520
N-[(1,5-dimethylpyrrol-2-yl)methyl]-2-propylpyrrolidine-2-carboxamide
CID 106974307
N-(2,6-diethylphenyl)-2-propylpyrrolidine-2-carboxamide
CID 106973997
1-amino-N-(2-hydroxy-2-phenylethyl)cyclohexane-1-carboxamide
CID 43500059

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide?
The IUPAC name of N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide (CID 106974225) is N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide?
The canonical SMILES for N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide is CCCC1(C(=O)NCC(O)c2ccccc2)CCCN1.
What is the InChIKey of N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide?
The InChIKey is FYAIKAXCRFOZNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-2-9-16(10-6-11-18-16)15(20)17-12-14(19)13-7-4-3-5-8-13/h3-5,7-8,14,18-19H,2,6,9-12H2,1H3,(H,17,20).
What are the key properties of N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide?
N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.76, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide is sourced from PubChem (CID 106974225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).