2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide

C14H13N5O2 — CID 155909000

IUPAC2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide
SMILESCOc1ncccc1C(=O)Nc1ccc2nn(C)nc2c1
InChIInChI=1S/C14H13N5O2/c1-19-17-11-6-5-9(8-12(11)18-19)16-13(20)10-4-3-7-15-14(10)21-2/h3-8H,1-2H3,(H,16,20)
InChIKeyXEGBATLTXQQWKL-UHFFFAOYSA-N
MW283.29 g/mol
LogP1.62
Rot. Bonds3

About 2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide

2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide (PubChem CID 155909000) has the molecular formula C14H13N5O2 and a molecular weight of 283.29 g/mol. Its IUPAC name is 2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide
PubChem CID155909000
Molecular FormulaC14H13N5O2
Molecular Weight283.29 g/mol
Exact Mass283.11
IUPAC Name2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide
SMILESCOc1ncccc1C(=O)Nc1ccc2nn(C)nc2c1
InChIInChI=1S/C14H13N5O2/c1-19-17-11-6-5-9(8-12(11)18-19)16-13(20)10-4-3-7-15-14(10)21-2/h3-8H,1-2H3,(H,16,20)
InChIKeyXEGBATLTXQQWKL-UHFFFAOYSA-N
XLogP1.62
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3,4-dimethoxyphenyl)-2-methoxypyridine-3-carboxamide
CID 84580737
2-methoxy-N-[3-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 110860867
N-[3-(chloromethyl)phenyl]-2-methoxypyridine-3-carboxamide
CID 113270952
N-(3-cyanophenyl)-2-methoxypyridine-3-carboxamide
CID 55023858
2-methoxy-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyridine-3-carboxamide
CID 63900928
2-(2-methoxyethoxy)-N-quinolin-6-ylpyridine-3-carboxamide
CID 60573798
N-(2-imidazol-1-ylpyrimidin-5-yl)-2-methoxypyridine-3-carboxamide
CID 122300910
N-[4-(2-hydroxyethyl)phenyl]-2-methoxypyridine-3-carboxamide
CID 61223971
N-(2,6-dichlorophenyl)-2-methoxypyridine-3-carboxamide
CID 110864324
N-[4-(2-chloroethyl)phenyl]-2-methoxypyridine-3-carboxamide
CID 114299271
2-methoxy-N-[4-(3-methylbutanoylamino)phenyl]pyridine-3-carboxamide
CID 134002839
N-[3-chloro-4-(propanoylamino)phenyl]-2-methoxypyridine-3-carboxamide
CID 50968912

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide?
The IUPAC name of 2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide (CID 155909000) is 2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide is COc1ncccc1C(=O)Nc1ccc2nn(C)nc2c1.
What is the InChIKey of 2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide?
The InChIKey is XEGBATLTXQQWKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5O2/c1-19-17-11-6-5-9(8-12(11)18-19)16-13(20)10-4-3-7-15-14(10)21-2/h3-8H,1-2H3,(H,16,20).
What are the key properties of 2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide?
2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide has a molecular weight of 283.29 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(2-methylbenzotriazol-5-yl)pyridine-3-carboxamide is sourced from PubChem (CID 155909000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).