2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine

C15H13FN4 — CID 104740713

IUPAC2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine
SMILESNc1cccnc1-c1nc2c(F)cccc2n1C1CC1
InChIInChI=1S/C15H13FN4/c16-10-3-1-5-12-13(10)19-15(20(12)9-6-7-9)14-11(17)4-2-8-18-14/h1-5,8-9H,6-7,17H2
InChIKeyNSSRUYIELQRDSA-UHFFFAOYSA-N
MW268.30 g/mol
LogP3.15
Rot. Bonds2

About 2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine

2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine (PubChem CID 104740713) has the molecular formula C15H13FN4 and a molecular weight of 268.30 g/mol. Its IUPAC name is 2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine
PubChem CID104740713
Molecular FormulaC15H13FN4
Molecular Weight268.30 g/mol
Exact Mass268.11
IUPAC Name2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine
SMILESNc1cccnc1-c1nc2c(F)cccc2n1C1CC1
InChIInChI=1S/C15H13FN4/c16-10-3-1-5-12-13(10)19-15(20(12)9-6-7-9)14-11(17)4-2-8-18-14/h1-5,8-9H,6-7,17H2
InChIKeyNSSRUYIELQRDSA-UHFFFAOYSA-N
XLogP3.15
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.30
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)-6-methylaniline
CID 60785396
2-bromo-6-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)aniline
CID 63112874
4-chloro-3-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)aniline
CID 60862547
4-fluoro-1-piperidin-4-ylbenzimidazol-2-amine
CID 84796902
4-fluoro-2-methyl-1-piperidin-4-ylbenzimidazole
CID 84796160
1-(4-ethylcyclohexyl)-4-fluorobenzimidazol-2-amine
CID 61470261
5-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)-2-methylphenol
CID 60784309
(1-cyclopropyl-4-fluorobenzimidazol-2-yl)methanol
CID 63756402
3-(4-fluoro-1-methylbenzimidazol-2-yl)pyrazin-2-amine
CID 63262129
3-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)-2,3-dimethylbutan-2-amine
CID 65261178
2-bromo-1-cyclobutyl-4-fluorobenzimidazole
CID 84808519
2-[(1-cyclopropyl-4-fluorobenzimidazol-2-yl)methoxy]ethanamine
CID 79456560

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine?
The IUPAC name of 2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine (CID 104740713) is 2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine.
What is the SMILES notation for 2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine?
The canonical SMILES for 2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine is Nc1cccnc1-c1nc2c(F)cccc2n1C1CC1.
What is the InChIKey of 2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine?
The InChIKey is NSSRUYIELQRDSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN4/c16-10-3-1-5-12-13(10)19-15(20(12)9-6-7-9)14-11(17)4-2-8-18-14/h1-5,8-9H,6-7,17H2.
What are the key properties of 2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine?
2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine has a molecular weight of 268.30 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopropyl-4-fluorobenzimidazol-2-yl)pyridin-3-amine is sourced from PubChem (CID 104740713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).