N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide

C15H16N2O2 — CID 110857659

IUPACN-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide
SMILESCOc1cc(C(=O)Nc2cccc(C)c2C)ccn1
InChIInChI=1S/C15H16N2O2/c1-10-5-4-6-13(11(10)2)17-15(18)12-7-8-16-14(9-12)19-3/h4-9H,1-3H3,(H,17,18)
InChIKeyVVNMHQIHGHKVGI-UHFFFAOYSA-N
MW256.30 g/mol
LogP2.96
Rot. Bonds3

About N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide

N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide (PubChem CID 110857659) has the molecular formula C15H16N2O2 and a molecular weight of 256.30 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide
PubChem CID110857659
Molecular FormulaC15H16N2O2
Molecular Weight256.30 g/mol
Exact Mass256.12
IUPAC NameN-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide
SMILESCOc1cc(C(=O)Nc2cccc(C)c2C)ccn1
InChIInChI=1S/C15H16N2O2/c1-10-5-4-6-13(11(10)2)17-15(18)12-7-8-16-14(9-12)19-3/h4-9H,1-3H3,(H,17,18)
InChIKeyVVNMHQIHGHKVGI-UHFFFAOYSA-N
XLogP2.96
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide (CID 110857659) is N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide is COc1cc(C(=O)Nc2cccc(C)c2C)ccn1.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide?
The InChIKey is VVNMHQIHGHKVGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10-5-4-6-13(11(10)2)17-15(18)12-7-8-16-14(9-12)19-3/h4-9H,1-3H3,(H,17,18).
What are the key properties of N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide?
N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide has a molecular weight of 256.30 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2-methoxypyridine-4-carboxamide is sourced from PubChem (CID 110857659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).