3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid

C18H14N2O3 — CID 71767584

IUPAC3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid
SMILESO=C(Cc1ccc2ccccc2c1)Nc1cnccc1C(=O)O
InChIInChI=1S/C18H14N2O3/c21-17(20-16-11-19-8-7-15(16)18(22)23)10-12-5-6-13-3-1-2-4-14(13)9-12/h1-9,11H,10H2,(H,20,21)(H,22,23)
InChIKeyXCJSNBVUFKTWCD-UHFFFAOYSA-N
MW306.32 g/mol
LogP3.11
Rot. Bonds4

About 3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid

3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid (PubChem CID 71767584) has the molecular formula C18H14N2O3 and a molecular weight of 306.32 g/mol. Its IUPAC name is 3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid
PubChem CID71767584
Molecular FormulaC18H14N2O3
Molecular Weight306.32 g/mol
Exact Mass306.10
IUPAC Name3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid
SMILESO=C(Cc1ccc2ccccc2c1)Nc1cnccc1C(=O)O
InChIInChI=1S/C18H14N2O3/c21-17(20-16-11-19-8-7-15(16)18(22)23)10-12-5-6-13-3-1-2-4-14(13)9-12/h1-9,11H,10H2,(H,20,21)(H,22,23)
InChIKeyXCJSNBVUFKTWCD-UHFFFAOYSA-N
XLogP3.11
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.32
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid 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

3-(4-naphthalen-2-ylbutanoylamino)pyridine-4-carboxylic acid
CID 71767585
2-naphthalen-2-yl-N-pyridin-4-ylacetamide
CID 25336159
N-naphthalen-1-yl-2-naphthalen-2-ylacetamide
CID 16849654
2-[2-(isoquinolin-8-ylamino)-2-oxoethyl]benzoic acid
CID 11779892
N-[3,5-bis[(2-naphthalen-2-ylacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide
CID 67257199
2-[4-[(2-naphthalen-2-ylacetyl)amino]phenyl]acetic acid
CID 6461297
N-(8-methylquinolin-5-yl)-2-naphthalen-2-ylacetamide
CID 38280575
2-[(2-naphthalen-2-ylacetyl)amino]-N-(2-phenylethyl)benzamide
CID 38112777
N-(3-hydroxyphenyl)-2-naphthalen-2-ylacetamide
CID 28739776
1-(3-chloro-4-pyridinyl)-3-naphthalen-2-ylpropan-2-one
CID 105107606
2-isoquinolin-6-ylacetic acid
CID 19098542
4-bromo-2-[(2-pyridin-3-ylacetyl)amino]benzoic acid
CID 62691044

Frequently Asked Questions

What is the IUPAC name of 3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid?
The IUPAC name of 3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid (CID 71767584) is 3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid.
What is the SMILES notation for 3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid?
The canonical SMILES for 3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid is O=C(Cc1ccc2ccccc2c1)Nc1cnccc1C(=O)O.
What is the InChIKey of 3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid?
The InChIKey is XCJSNBVUFKTWCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O3/c21-17(20-16-11-19-8-7-15(16)18(22)23)10-12-5-6-13-3-1-2-4-14(13)9-12/h1-9,11H,10H2,(H,20,21)(H,22,23).
What are the key properties of 3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid?
3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid has a molecular weight of 306.32 g/mol, XLogP of 3.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-naphthalen-2-ylacetyl)amino]pyridine-4-carboxylic acid is sourced from PubChem (CID 71767584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).