N-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide

C17H26N2O — CID 106974945

IUPACN-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)NCC(C)c2ccccc2)CCCN1
InChIInChI=1S/C17H26N2O/c1-3-10-17(11-7-12-19-17)16(20)18-13-14(2)15-8-5-4-6-9-15/h4-6,8-9,14,19H,3,7,10-13H2,1-2H3,(H,18,20)
InChIKeyGSXMQVCKNBRHBQ-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.83
Rot. Bonds6

About N-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide

N-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide (PubChem CID 106974945) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide
PubChem CID106974945
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide
SMILESCCCC1(C(=O)NCC(C)c2ccccc2)CCCN1
InChIInChI=1S/C17H26N2O/c1-3-10-17(11-7-12-19-17)16(20)18-13-14(2)15-8-5-4-6-9-15/h4-6,8-9,14,19H,3,7,10-13H2,1-2H3,(H,18,20)
InChIKeyGSXMQVCKNBRHBQ-UHFFFAOYSA-N
XLogP2.83
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-hydroxy-2-phenylethyl)-2-propylpyrrolidine-2-carboxamide
CID 106974225
N-(2,3-dimethylbutyl)-2-propylpyrrolidine-2-carboxamide
CID 106975317
N-(2,2-dimethoxyethyl)-2-propylpyrrolidine-2-carboxamide
CID 106974916
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-[1-(2-fluorophenyl)ethyl]-2-propylpyrrolidine-2-carboxamide
CID 106974513
N-(2,6-diethylphenyl)-2-propylpyrrolidine-2-carboxamide
CID 106973997
N-[1-(3-chlorophenyl)propyl]-2-propylpyrrolidine-2-carboxamide
CID 106974342
N-[(3-cyanophenyl)methyl]-2-propylpyrrolidine-2-carboxamide
CID 106974506
3-[(2-ethylpyrrolidine-2-carbonyl)amino]-2-methylpropanoic acid
CID 83071374
N-(4-ethylphenyl)-2-propylpyrrolidine-2-carboxamide
CID 106974084

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide?
The IUPAC name of N-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide (CID 106974945) is N-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide?
The canonical SMILES for N-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide is CCCC1(C(=O)NCC(C)c2ccccc2)CCCN1.
What is the InChIKey of N-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide?
The InChIKey is GSXMQVCKNBRHBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-3-10-17(11-7-12-19-17)16(20)18-13-14(2)15-8-5-4-6-9-15/h4-6,8-9,14,19H,3,7,10-13H2,1-2H3,(H,18,20).
What are the key properties of N-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide?
N-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide has a molecular weight of 274.41 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylpropyl)-2-propylpyrrolidine-2-carboxamide is sourced from PubChem (CID 106974945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).