N-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide

C16H16N4O2 — CID 43053714

IUPACN-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide
SMILESCCn1c(NC(=O)c2cccnc2OC)nc2ccccc21
InChIInChI=1S/C16H16N4O2/c1-3-20-13-9-5-4-8-12(13)18-16(20)19-14(21)11-7-6-10-17-15(11)22-2/h4-10H,3H2,1-2H3,(H,18,19,21)
InChIKeyVYFSTKCQJZALBM-UHFFFAOYSA-N
MW296.33 g/mol
LogP2.71
Rot. Bonds4

About N-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide

N-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide (PubChem CID 43053714) has the molecular formula C16H16N4O2 and a molecular weight of 296.33 g/mol. Its IUPAC name is N-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide
PubChem CID43053714
Molecular FormulaC16H16N4O2
Molecular Weight296.33 g/mol
Exact Mass296.13
IUPAC NameN-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide
SMILESCCn1c(NC(=O)c2cccnc2OC)nc2ccccc21
InChIInChI=1S/C16H16N4O2/c1-3-20-13-9-5-4-8-12(13)18-16(20)19-14(21)11-7-6-10-17-15(11)22-2/h4-10H,3H2,1-2H3,(H,18,19,21)
InChIKeyVYFSTKCQJZALBM-UHFFFAOYSA-N
XLogP2.71
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-ethylbenzimidazol-2-yl)-2-iodobenzamide
CID 27897993
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5-chloro-N-(1-ethylbenzimidazol-2-yl)-2-methoxybenzamide
CID 27898030
2-[2-(dimethylamino)ethoxy]-N-(1-ethylbenzimidazol-2-yl)benzamide
CID 46970461
N-(1-ethylbenzimidazol-2-yl)-2-(4-methoxyphenoxy)acetamide
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CID 46540923
4-cyano-N-(1-ethylbenzimidazol-2-yl)benzamide
CID 27148276
(1-ethylbenzimidazol-2-yl)carbamoyl acetate
CID 127259054
1-(1-ethylbenzimidazol-2-yl)-3-(3-methoxyphenyl)urea
CID 35279970
2-[(2-methoxypyridine-3-carbonyl)amino]pyridine-3-carboxylic acid
CID 63654787
2-amino-N-(1-ethylbenzimidazol-2-yl)acetamide;hydrochloride
CID 119265457
2-ethoxy-N'-(3-ethyl-4-oxoquinazolin-2-yl)pyridine-3-carbohydrazide
CID 18139335

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide?
The IUPAC name of N-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide (CID 43053714) is N-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide?
The canonical SMILES for N-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide is CCn1c(NC(=O)c2cccnc2OC)nc2ccccc21.
What is the InChIKey of N-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide?
The InChIKey is VYFSTKCQJZALBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O2/c1-3-20-13-9-5-4-8-12(13)18-16(20)19-14(21)11-7-6-10-17-15(11)22-2/h4-10H,3H2,1-2H3,(H,18,19,21).
What are the key properties of N-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide?
N-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide has a molecular weight of 296.33 g/mol, XLogP of 2.71, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylbenzimidazol-2-yl)-2-methoxypyridine-3-carboxamide is sourced from PubChem (CID 43053714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).