2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide

C16H15FN4O — CID 53143732

IUPAC2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide
SMILESCn1c(CCNC(=O)c2ccccc2F)nc2cccnc21
InChIInChI=1S/C16H15FN4O/c1-21-14(20-13-7-4-9-18-15(13)21)8-10-19-16(22)11-5-2-3-6-12(11)17/h2-7,9H,8,10H2,1H3,(H,19,22)
InChIKeyUPHNHJWBHSDLOH-UHFFFAOYSA-N
MW298.32 g/mol
LogP2.08
Rot. Bonds4

About 2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide

2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide (PubChem CID 53143732) has the molecular formula C16H15FN4O and a molecular weight of 298.32 g/mol. Its IUPAC name is 2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide
PubChem CID53143732
Molecular FormulaC16H15FN4O
Molecular Weight298.32 g/mol
Exact Mass298.12
IUPAC Name2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide
SMILESCn1c(CCNC(=O)c2ccccc2F)nc2cccnc21
InChIInChI=1S/C16H15FN4O/c1-21-14(20-13-7-4-9-18-15(13)21)8-10-19-16(22)11-5-2-3-6-12(11)17/h2-7,9H,8,10H2,1H3,(H,19,22)
InChIKeyUPHNHJWBHSDLOH-UHFFFAOYSA-N
XLogP2.08
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.32
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-fluoro-N-[2-(1-methylimidazol-2-yl)ethyl]benzamide
CID 61215487
2-fluoro-N-[(1-methylbenzimidazol-2-yl)methyl]benzamide
CID 17007726
2-methoxy-N-[2-(3-propylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide
CID 71842723
2-(3-methoxyphenyl)-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]acetamide
CID 53143714
N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]propan-2-amine
CID 63756762
N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]-3-fluorobenzamide
CID 71842734
2-methoxy-N-[2-[3-(2-methylpropyl)imidazo[4,5-b]pyridin-2-yl]ethyl]benzamide
CID 50843507
N-[2-[5-[(2-chlorobenzoyl)amino]-1-methylbenzimidazol-2-yl]ethyl]-2-fluorobenzamide
CID 50751454
5-(3-methylimidazo[4,5-b]pyridin-2-yl)pentanoic acid
CID 63757796
3,4-difluoro-N-[2-(1-methylbenzimidazol-2-yl)ethyl]benzamide
CID 110711954
N-[2-[5-(butanoylamino)-1-methylbenzimidazol-2-yl]ethyl]-2-fluorobenzamide
CID 50752067
2-(fluoromethyl)-3-methylimidazo[4,5-b]pyridine
CID 141030581

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide?
The IUPAC name of 2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide (CID 53143732) is 2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide?
The canonical SMILES for 2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide is Cn1c(CCNC(=O)c2ccccc2F)nc2cccnc21.
What is the InChIKey of 2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide?
The InChIKey is UPHNHJWBHSDLOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN4O/c1-21-14(20-13-7-4-9-18-15(13)21)8-10-19-16(22)11-5-2-3-6-12(11)17/h2-7,9H,8,10H2,1H3,(H,19,22).
What are the key properties of 2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide?
2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide has a molecular weight of 298.32 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[2-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]benzamide is sourced from PubChem (CID 53143732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).