N-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide

C14H11N3O2 — CID 170421222

IUPACN-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide
SMILESCc1ccc2oc(NC(=O)c3ccccn3)nc2c1
InChIInChI=1S/C14H11N3O2/c1-9-5-6-12-11(8-9)16-14(19-12)17-13(18)10-4-2-3-7-15-10/h2-8H,1H3,(H,16,17,18)
InChIKeyJQFKIHZXSGPPGT-UHFFFAOYSA-N
MW253.26 g/mol
LogP2.78
Rot. Bonds2

About N-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide

N-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide (PubChem CID 170421222) has the molecular formula C14H11N3O2 and a molecular weight of 253.26 g/mol. Its IUPAC name is N-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide
PubChem CID170421222
Molecular FormulaC14H11N3O2
Molecular Weight253.26 g/mol
Exact Mass253.09
IUPAC NameN-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide
SMILESCc1ccc2oc(NC(=O)c3ccccn3)nc2c1
InChIInChI=1S/C14H11N3O2/c1-9-5-6-12-11(8-9)16-14(19-12)17-13(18)10-4-2-3-7-15-10/h2-8H,1H3,(H,16,17,18)
InChIKeyJQFKIHZXSGPPGT-UHFFFAOYSA-N
XLogP2.78
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-methyl-2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide
CID 4867706
N-(2-tert-butyl-1,3-benzoxazol-5-yl)pyridine-2-carboxamide
CID 46416181
N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 46307927
dichloromanganese;bis(N-(4-methylphenyl)pyridine-2-carboxamide)
CID 11455628
N-(2-amino-4-methylphenyl)pyridine-2-carboxamide
CID 43259115
5-methyl-2-pyridin-2-yl-1,3-benzoxazole
CID 12031006
4-methoxy-N-[(5-methyl-1,3-benzoxazol-2-yl)carbamothioyl]benzamide
CID 11405099
N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide
CID 19224279
(1R,6R)-6-[(5-methyl-1,3-benzoxazol-2-yl)amino]cyclohex-3-ene-1-carboxamide
CID 122563304
4-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxylic acid
CID 175214662
1,1-dimethyl-3-[4-[(5-methyl-1,3-benzoxazol-2-yl)amino]phenyl]urea
CID 118289402
N-ethyl-5-methyl-1,3-benzoxazol-2-amine
CID 15684675

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide?
The IUPAC name of N-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide (CID 170421222) is N-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide?
The canonical SMILES for N-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide is Cc1ccc2oc(NC(=O)c3ccccn3)nc2c1.
What is the InChIKey of N-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide?
The InChIKey is JQFKIHZXSGPPGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3O2/c1-9-5-6-12-11(8-9)16-14(19-12)17-13(18)10-4-2-3-7-15-10/h2-8H,1H3,(H,16,17,18).
What are the key properties of N-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide?
N-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide has a molecular weight of 253.26 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,3-benzoxazol-2-yl)pyridine-2-carboxamide is sourced from PubChem (CID 170421222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).