N-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide

C17H17N3O2 — CID 665732

IUPACN-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide
SMILESCCC(=O)Nc1ccc2c(c1)ncn2-c1ccccc1OC
InChIInChI=1S/C17H17N3O2/c1-3-17(21)19-12-8-9-14-13(10-12)18-11-20(14)15-6-4-5-7-16(15)22-2/h4-11H,3H2,1-2H3,(H,19,21)
InChIKeySRBLIYOJSLLBOB-UHFFFAOYSA-N
MW295.34 g/mol
LogP3.38
Rot. Bonds4

About N-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide

N-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide (PubChem CID 665732) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is N-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide.

Molecular Properties

Compound NameN-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide
PubChem CID665732
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC NameN-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide
SMILESCCC(=O)Nc1ccc2c(c1)ncn2-c1ccccc1OC
InChIInChI=1S/C17H17N3O2/c1-3-17(21)19-12-8-9-14-13(10-12)18-11-20(14)15-6-4-5-7-16(15)22-2/h4-11H,3H2,1-2H3,(H,19,21)
InChIKeySRBLIYOJSLLBOB-UHFFFAOYSA-N
XLogP3.38
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide?
The IUPAC name of N-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide (CID 665732) is N-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide.
What is the SMILES notation for N-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide?
The canonical SMILES for N-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide is CCC(=O)Nc1ccc2c(c1)ncn2-c1ccccc1OC.
What is the InChIKey of N-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide?
The InChIKey is SRBLIYOJSLLBOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-3-17(21)19-12-8-9-14-13(10-12)18-11-20(14)15-6-4-5-7-16(15)22-2/h4-11H,3H2,1-2H3,(H,19,21).
What are the key properties of N-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide?
N-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide has a molecular weight of 295.34 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyphenyl)benzimidazol-5-yl]propanamide is sourced from PubChem (CID 665732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).