3,4-diphenyl-N-pyrrolidin-3-ylbutanamide

C20H24N2O — CID 119451866

IUPAC3,4-diphenyl-N-pyrrolidin-3-ylbutanamide
SMILESO=C(CC(Cc1ccccc1)c1ccccc1)NC1CCNC1
InChIInChI=1S/C20H24N2O/c23-20(22-19-11-12-21-15-19)14-18(17-9-5-2-6-10-17)13-16-7-3-1-4-8-16/h1-10,18-19,21H,11-15H2,(H,22,23)
InChIKeyAMPFQPJFCAZCLM-UHFFFAOYSA-N
MW308.43 g/mol
LogP2.88
Rot. Bonds6

About 3,4-diphenyl-N-pyrrolidin-3-ylbutanamide

3,4-diphenyl-N-pyrrolidin-3-ylbutanamide (PubChem CID 119451866) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is 3,4-diphenyl-N-pyrrolidin-3-ylbutanamide.

Molecular Properties

Compound Name3,4-diphenyl-N-pyrrolidin-3-ylbutanamide
PubChem CID119451866
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC Name3,4-diphenyl-N-pyrrolidin-3-ylbutanamide
SMILESO=C(CC(Cc1ccccc1)c1ccccc1)NC1CCNC1
InChIInChI=1S/C20H24N2O/c23-20(22-19-11-12-21-15-19)14-18(17-9-5-2-6-10-17)13-16-7-3-1-4-8-16/h1-10,18-19,21H,11-15H2,(H,22,23)
InChIKeyAMPFQPJFCAZCLM-UHFFFAOYSA-N
XLogP2.88
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-phenyl-N-[(3S)-pyrrolidin-3-yl]acetamide
CID 79688083
2,2-diphenyl-N-pyrrolidin-3-ylacetamide
CID 21221994
2-phenyl-N-piperidin-4-ylacetamide
CID 1445168
4-methyl-3-phenyl-N-piperidin-3-ylpentanamide;hydrochloride
CID 119424594
3-(carbamoylamino)-3-(3-phenoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119450732
3-methyl-2-phenyl-N-pyrrolidin-3-ylbutanamide
CID 119449948
(2-phenyl-1-pyrrolidin-3-ylethyl)carbamic acid
CID 67098900
3-phenyl-2-[(3S)-pyrrolidin-3-yl]propanoic acid
CID 166708021
3-phenyl-N-piperidin-4-ylpropanamide
CID 16795625
1-cyclopropyl-3-(2,3-diphenylpropyl)urea
CID 110307425
5-[(4-hydroxycyclohexyl)amino]-5-oxo-3-phenylpentanoic acid
CID 102551934
N-[1-(1-phenylethyl)piperidin-4-yl]-3-piperidin-4-ylbutanamide
CID 119879223

Frequently Asked Questions

What is the IUPAC name of 3,4-diphenyl-N-pyrrolidin-3-ylbutanamide?
The IUPAC name of 3,4-diphenyl-N-pyrrolidin-3-ylbutanamide (CID 119451866) is 3,4-diphenyl-N-pyrrolidin-3-ylbutanamide.
What is the SMILES notation for 3,4-diphenyl-N-pyrrolidin-3-ylbutanamide?
The canonical SMILES for 3,4-diphenyl-N-pyrrolidin-3-ylbutanamide is O=C(CC(Cc1ccccc1)c1ccccc1)NC1CCNC1.
What is the InChIKey of 3,4-diphenyl-N-pyrrolidin-3-ylbutanamide?
The InChIKey is AMPFQPJFCAZCLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O/c23-20(22-19-11-12-21-15-19)14-18(17-9-5-2-6-10-17)13-16-7-3-1-4-8-16/h1-10,18-19,21H,11-15H2,(H,22,23).
What are the key properties of 3,4-diphenyl-N-pyrrolidin-3-ylbutanamide?
3,4-diphenyl-N-pyrrolidin-3-ylbutanamide has a molecular weight of 308.43 g/mol, XLogP of 2.88, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-diphenyl-N-pyrrolidin-3-ylbutanamide is sourced from PubChem (CID 119451866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).