N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide

C17H23N3O — CID 110786135

IUPACN-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide
SMILESCCCCC(=O)NCc1ccc2c(c1)nc(C1CC1)n2C
InChIInChI=1S/C17H23N3O/c1-3-4-5-16(21)18-11-12-6-9-15-14(10-12)19-17(20(15)2)13-7-8-13/h6,9-10,13H,3-5,7-8,11H2,1-2H3,(H,18,21)
InChIKeyUYJIYDDLAVDBBP-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.26
Rot. Bonds6

About N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide

N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide (PubChem CID 110786135) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide.

Molecular Properties

Compound NameN-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide
PubChem CID110786135
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC NameN-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide
SMILESCCCCC(=O)NCc1ccc2c(c1)nc(C1CC1)n2C
InChIInChI=1S/C17H23N3O/c1-3-4-5-16(21)18-11-12-6-9-15-14(10-12)19-17(20(15)2)13-7-8-13/h6,9-10,13H,3-5,7-8,11H2,1-2H3,(H,18,21)
InChIKeyUYJIYDDLAVDBBP-UHFFFAOYSA-N
XLogP3.26
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 110773369
N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]-2-(3-fluorophenyl)acetamide
CID 110786170
N-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]propanamide
CID 110791866
4-(2-cyclopropyl-1-methylbenzimidazol-5-yl)butan-2-one
CID 82497246
2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-(2-methylpropyl)acetamide
CID 110773345
N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]-2-methoxybenzamide
CID 110786150
1-benzyl-3-[2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)ethyl]urea
CID 110776249
2-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methylcarbamoyl]furan-3-carboxylic acid
CID 167881813
N-[(2-methyl-1-propan-2-ylbenzimidazol-5-yl)methyl]pentanamide
CID 110786061
2-cyclopropyl-5-[(dimethylsulfamoylamino)methyl]-1-methylbenzimidazole
CID 110786179
3-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-N-methylpropan-1-amine
CID 96674760
1-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-2-methylpropan-2-amine
CID 82497493

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide?
The IUPAC name of N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide (CID 110786135) is N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide.
What is the SMILES notation for N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide?
The canonical SMILES for N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide is CCCCC(=O)NCc1ccc2c(c1)nc(C1CC1)n2C.
What is the InChIKey of N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide?
The InChIKey is UYJIYDDLAVDBBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-3-4-5-16(21)18-11-12-6-9-15-14(10-12)19-17(20(15)2)13-7-8-13/h6,9-10,13H,3-5,7-8,11H2,1-2H3,(H,18,21).
What are the key properties of N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide?
N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide has a molecular weight of 285.39 g/mol, XLogP of 3.26, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclopropyl-1-methylbenzimidazol-5-yl)methyl]pentanamide is sourced from PubChem (CID 110786135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).