(5-amino-2-pyridinyl)-(2-methylphenyl)methanone

C13H12N2O — CID 116605299

IUPAC(5-amino-2-pyridinyl)-(2-methylphenyl)methanone
SMILESCc1ccccc1C(=O)c1ccc(N)cn1
InChIInChI=1S/C13H12N2O/c1-9-4-2-3-5-11(9)13(16)12-7-6-10(14)8-15-12/h2-8H,14H2,1H3
InChIKeyPNMJDYPXUVXUMN-UHFFFAOYSA-N
MW212.25 g/mol
LogP2.20
Rot. Bonds2

About (5-amino-2-pyridinyl)-(2-methylphenyl)methanone

(5-amino-2-pyridinyl)-(2-methylphenyl)methanone (PubChem CID 116605299) has the molecular formula C13H12N2O and a molecular weight of 212.25 g/mol. Its IUPAC name is (5-amino-2-pyridinyl)-(2-methylphenyl)methanone.

Molecular Properties

Compound Name(5-amino-2-pyridinyl)-(2-methylphenyl)methanone
PubChem CID116605299
Molecular FormulaC13H12N2O
Molecular Weight212.25 g/mol
Exact Mass212.09
IUPAC Name(5-amino-2-pyridinyl)-(2-methylphenyl)methanone
SMILESCc1ccccc1C(=O)c1ccc(N)cn1
InChIInChI=1S/C13H12N2O/c1-9-4-2-3-5-11(9)13(16)12-7-6-10(14)8-15-12/h2-8H,14H2,1H3
InChIKeyPNMJDYPXUVXUMN-UHFFFAOYSA-N
XLogP2.20
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-fluoro-2-pyridinyl)-(2-methylphenyl)methanone
CID 79722365
(5-amino-2-pyridinyl)-isoquinolin-4-ylmethanone
CID 116605172
(5-amino-2-pyridinyl)-(1H-indol-3-yl)methanone
CID 112742464
(5-amino-2-pyridinyl)-(3-bromo-2-fluorophenyl)methanone
CID 106647263
[2-(2-methylbenzoyl)phenyl]-(2-methylphenyl)methanone
CID 15597717
(5-amino-2-pyridinyl)-(4-fluoro-3-methylphenyl)methanone
CID 116605281
5-amino-N-[2-(methylcarbamoyl)phenyl]pyridine-2-carboxamide
CID 81316970
(5-amino-2-pyridinyl)-(3,5-dimethoxyphenyl)methanone
CID 116605219
(5-amino-2-methoxyphenyl)-(2-methylphenyl)methanone
CID 82084658
(5-amino-2-pyridinyl)-(4-chloro-2-fluorophenyl)methanone
CID 116605357
[2-(2-methylanilino)-2-oxoethyl] 5-aminopyridine-2-carboxylate
CID 81312802
(5-amino-2-pyridinyl)-(5-bromo-2-fluorophenyl)methanone
CID 116605258

Frequently Asked Questions

What is the IUPAC name of (5-amino-2-pyridinyl)-(2-methylphenyl)methanone?
The IUPAC name of (5-amino-2-pyridinyl)-(2-methylphenyl)methanone (CID 116605299) is (5-amino-2-pyridinyl)-(2-methylphenyl)methanone.
What is the SMILES notation for (5-amino-2-pyridinyl)-(2-methylphenyl)methanone?
The canonical SMILES for (5-amino-2-pyridinyl)-(2-methylphenyl)methanone is Cc1ccccc1C(=O)c1ccc(N)cn1.
What is the InChIKey of (5-amino-2-pyridinyl)-(2-methylphenyl)methanone?
The InChIKey is PNMJDYPXUVXUMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O/c1-9-4-2-3-5-11(9)13(16)12-7-6-10(14)8-15-12/h2-8H,14H2,1H3.
What are the key properties of (5-amino-2-pyridinyl)-(2-methylphenyl)methanone?
(5-amino-2-pyridinyl)-(2-methylphenyl)methanone has a molecular weight of 212.25 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-2-pyridinyl)-(2-methylphenyl)methanone is sourced from PubChem (CID 116605299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).