2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide

C21H21N3O — CID 168957839

IUPAC2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide
SMILESCc1ncccc1NC(=O)CNC(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H21N3O/c1-16-19(13-8-14-22-16)24-20(25)15-23-21(17-9-4-2-5-10-17)18-11-6-3-7-12-18/h2-14,21,23H,15H2,1H3,(H,24,25)
InChIKeyKKHNGVZVRXRZPT-UHFFFAOYSA-N
MW331.42 g/mol
LogP3.71
Rot. Bonds6

About 2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide

2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide (PubChem CID 168957839) has the molecular formula C21H21N3O and a molecular weight of 331.42 g/mol. Its IUPAC name is 2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide
PubChem CID168957839
Molecular FormulaC21H21N3O
Molecular Weight331.42 g/mol
Exact Mass331.17
IUPAC Name2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide
SMILESCc1ncccc1NC(=O)CNC(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H21N3O/c1-16-19(13-8-14-22-16)24-20(25)15-23-21(17-9-4-2-5-10-17)18-11-6-3-7-12-18/h2-14,21,23H,15H2,1H3,(H,24,25)
InChIKeyKKHNGVZVRXRZPT-UHFFFAOYSA-N
XLogP3.71
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide 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-methyl-3-pyridinyl)-2-(propan-2-ylamino)acetamide
CID 79044146
2-(benzhydrylamino)-N-quinolin-5-ylacetamide
CID 42126505
N-(2-acetylphenyl)-2-(benzhydrylamino)acetamide
CID 7971269
N-(2-methyl-3-pyridinyl)-2-sulfanylacetamide
CID 79044042
2-chloro-N-(2-methyl-3-pyridinyl)-2-phenylacetamide
CID 79041942
2-(benzhydrylamino)-N-(2-phenylphenyl)acetamide;hydrochloride
CID 68964079
3-amino-N-(2-methyl-3-pyridinyl)propanamide
CID 79042008
N-(2-acetylphenyl)-2-[[(S)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 9393487
2-[[(R)-(4-methylphenyl)-phenylmethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 9393079
N-(2-methoxyphenyl)-2-[[(R)-(4-methylphenyl)-phenylmethyl]amino]acetamide
CID 9392871
3-amino-N-(2-methyl-3-pyridinyl)-3-sulfanylidenepropanamide
CID 79043985
2-(cyclopropylamino)-N-(2-methyl-3-pyridinyl)acetamide
CID 79043374

Frequently Asked Questions

What is the IUPAC name of 2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide?
The IUPAC name of 2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide (CID 168957839) is 2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide?
The canonical SMILES for 2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide is Cc1ncccc1NC(=O)CNC(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide?
The InChIKey is KKHNGVZVRXRZPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O/c1-16-19(13-8-14-22-16)24-20(25)15-23-21(17-9-4-2-5-10-17)18-11-6-3-7-12-18/h2-14,21,23H,15H2,1H3,(H,24,25).
What are the key properties of 2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide?
2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide has a molecular weight of 331.42 g/mol, XLogP of 3.71, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzhydrylamino)-N-(2-methyl-3-pyridinyl)acetamide is sourced from PubChem (CID 168957839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).