2-(benzhydrylamino)-N-quinolin-5-ylacetamide

C24H21N3O — CID 42126505

IUPAC2-(benzhydrylamino)-N-quinolin-5-ylacetamide
SMILESO=C(CNC(c1ccccc1)c1ccccc1)Nc1cccc2ncccc12
InChIInChI=1S/C24H21N3O/c28-23(27-22-15-7-14-21-20(22)13-8-16-25-21)17-26-24(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-16,24,26H,17H2,(H,27,28)
InChIKeyUJISGXNRDWOWKX-UHFFFAOYSA-N
MW367.45 g/mol
LogP4.55
Rot. Bonds6

About 2-(benzhydrylamino)-N-quinolin-5-ylacetamide

2-(benzhydrylamino)-N-quinolin-5-ylacetamide (PubChem CID 42126505) has the molecular formula C24H21N3O and a molecular weight of 367.45 g/mol. Its IUPAC name is 2-(benzhydrylamino)-N-quinolin-5-ylacetamide.

Molecular Properties

Compound Name2-(benzhydrylamino)-N-quinolin-5-ylacetamide
PubChem CID42126505
Molecular FormulaC24H21N3O
Molecular Weight367.45 g/mol
Exact Mass367.17
IUPAC Name2-(benzhydrylamino)-N-quinolin-5-ylacetamide
SMILESO=C(CNC(c1ccccc1)c1ccccc1)Nc1cccc2ncccc12
InChIInChI=1S/C24H21N3O/c28-23(27-22-15-7-14-21-20(22)13-8-16-25-21)17-26-24(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-16,24,26H,17H2,(H,27,28)
InChIKeyUJISGXNRDWOWKX-UHFFFAOYSA-N
XLogP4.55
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide
CID 168957839
2-chloro-N-quinolin-5-ylacetamide;hydrochloride
CID 155943918
2,2-dimethyl-N-[2-oxo-2-(quinolin-5-ylamino)ethyl]propanamide
CID 86977886
2-(prop-2-enylamino)-N-quinolin-5-ylacetamide
CID 112723293
3-hydroxy-3-phenyl-N-quinolin-5-ylbutanamide
CID 110024307
2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-quinolin-5-ylacetamide
CID 41364691
2-(4-hydroxyphenyl)-N-quinolin-5-ylacetamide
CID 78838145
3,3-dimethyl-N-quinolin-5-ylbutanamide
CID 24654624
2-phenyl-2-pyrrol-1-yl-N-quinolin-5-ylacetamide
CID 52992860
2-[[(R)-furan-2-yl(phenyl)methyl]amino]-N-naphthalen-1-ylacetamide
CID 8695978
2,3-dimethyl-4-oxo-4-(quinolin-5-ylamino)butanoic acid
CID 103496081
2-(2-phenylethoxy)-N-quinolin-5-ylacetamide
CID 86871261

Frequently Asked Questions

What is the IUPAC name of 2-(benzhydrylamino)-N-quinolin-5-ylacetamide?
The IUPAC name of 2-(benzhydrylamino)-N-quinolin-5-ylacetamide (CID 42126505) is 2-(benzhydrylamino)-N-quinolin-5-ylacetamide.
What is the SMILES notation for 2-(benzhydrylamino)-N-quinolin-5-ylacetamide?
The canonical SMILES for 2-(benzhydrylamino)-N-quinolin-5-ylacetamide is O=C(CNC(c1ccccc1)c1ccccc1)Nc1cccc2ncccc12.
What is the InChIKey of 2-(benzhydrylamino)-N-quinolin-5-ylacetamide?
The InChIKey is UJISGXNRDWOWKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O/c28-23(27-22-15-7-14-21-20(22)13-8-16-25-21)17-26-24(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-16,24,26H,17H2,(H,27,28).
What are the key properties of 2-(benzhydrylamino)-N-quinolin-5-ylacetamide?
2-(benzhydrylamino)-N-quinolin-5-ylacetamide has a molecular weight of 367.45 g/mol, XLogP of 4.55, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzhydrylamino)-N-quinolin-5-ylacetamide is sourced from PubChem (CID 42126505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).