6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid

C17H14N2O2 — CID 62369628

IUPAC6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(NCc2cccc3ccccc23)n1
InChIInChI=1S/C17H14N2O2/c20-17(21)15-9-4-10-16(19-15)18-11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10H,11H2,(H,18,19)(H,20,21)
InChIKeyTZKPKFPJBAJWIA-UHFFFAOYSA-N
MW278.31 g/mol
LogP3.55
Rot. Bonds4

About 6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid

6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid (PubChem CID 62369628) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is 6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid
PubChem CID62369628
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC Name6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid
SMILESO=C(O)c1cccc(NCc2cccc3ccccc23)n1
InChIInChI=1S/C17H14N2O2/c20-17(21)15-9-4-10-16(19-15)18-11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10H,11H2,(H,18,19)(H,20,21)
InChIKeyTZKPKFPJBAJWIA-UHFFFAOYSA-N
XLogP3.55
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-[[2-(trifluoromethyl)phenyl]methylamino]pyridine-2-carboxylic acid
CID 62879966
6-[(2-piperidin-1-ylsulfonylphenyl)methylamino]pyridine-2-carboxylic acid
CID 122053220
6-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)pyridine-2-carboxylic acid
CID 122054456
6-[[2-(aminomethyl)phenyl]methylamino]pyridine-2-carboxamide
CID 64590181
6-[[2-(2-methylphenyl)acetyl]amino]pyridine-2-carboxylic acid
CID 63641670
3-(naphthalen-1-ylmethylamino)pyrazine-2-carboxylic acid
CID 62711505
N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide
CID 133329112
5-(naphthalen-1-ylmethylamino)furan-2-carboxylic acid
CID 62369627
6-(cyclohexen-1-ylmethylamino)pyridine-2-carboxylic acid
CID 122057801
6-[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]pyridine-2-carboxylic acid
CID 106373120
tetrakis(2-naphthalen-1-ylacetic acid);samarium
CID 175232376
N-(6-chloro-2-pyridinyl)-2-naphthalen-1-ylacetamide
CID 115669454

Frequently Asked Questions

What is the IUPAC name of 6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid?
The IUPAC name of 6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid (CID 62369628) is 6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid.
What is the SMILES notation for 6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid?
The canonical SMILES for 6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid is O=C(O)c1cccc(NCc2cccc3ccccc23)n1.
What is the InChIKey of 6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid?
The InChIKey is TZKPKFPJBAJWIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2/c20-17(21)15-9-4-10-16(19-15)18-11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10H,11H2,(H,18,19)(H,20,21).
What are the key properties of 6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid?
6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid has a molecular weight of 278.31 g/mol, XLogP of 3.55, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(naphthalen-1-ylmethylamino)pyridine-2-carboxylic acid is sourced from PubChem (CID 62369628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).