N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide

C14H17N3O — CID 63860629

IUPACN-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide
SMILESCC1CC1CN(C)C(=O)c1ccc2nc[nH]c2c1
InChIInChI=1S/C14H17N3O/c1-9-5-11(9)7-17(2)14(18)10-3-4-12-13(6-10)16-8-15-12/h3-4,6,8-9,11H,5,7H2,1-2H3,(H,15,16)
InChIKeyQUFPIQRQCSCSGP-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.29
Rot. Bonds3

About N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide

N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide (PubChem CID 63860629) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide
PubChem CID63860629
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide
SMILESCC1CC1CN(C)C(=O)c1ccc2nc[nH]c2c1
InChIInChI=1S/C14H17N3O/c1-9-5-11(9)7-17(2)14(18)10-3-4-12-13(6-10)16-8-15-12/h3-4,6,8-9,11H,5,7H2,1-2H3,(H,15,16)
InChIKeyQUFPIQRQCSCSGP-UHFFFAOYSA-N
XLogP2.29
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-bicyclo[2.2.1]heptanylmethyl)-N-methyl-3H-benzimidazole-5-carboxamide
CID 63686305
N-methyl-N-(oxolan-2-ylmethyl)-3H-benzimidazole-5-carboxamide
CID 61433534
3-amino-N-methyl-N-[(2-methylcyclopropyl)methyl]benzamide
CID 63879392
N-(3-amino-4-methylpentyl)-N-methyl-3H-benzimidazole-5-carboxamide
CID 115317434
N-methyl-N-propan-2-yl-3H-benzimidazole-5-carboxamide
CID 43420531
N-methyl-N-(pyridin-2-ylmethyl)-3H-benzimidazole-5-carboxamide
CID 43582173
N-methyl-N-(1H-pyrazol-5-ylmethyl)-3H-benzimidazole-5-carboxamide
CID 29025706
N-methyl-N-(pyridin-3-ylmethyl)-3H-benzimidazole-5-carboxamide
CID 43397556
N-[3-(2-ethylphenyl)-2-oxopropyl]-N-methyl-3H-benzimidazole-5-carboxamide
CID 160963880
N-[2-(2,6-dichloroanilino)-2-oxoethyl]-N-methyl-3H-benzimidazole-5-carboxamide
CID 24688082
2-[3H-benzimidazole-5-carbonyl(tert-butyl)amino]acetic acid
CID 79265620
N-[(2-methylcyclopentyl)methyl]-3H-benzimidazole-5-carboxamide
CID 107420236

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide?
The IUPAC name of N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide (CID 63860629) is N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide.
What is the SMILES notation for N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide?
The canonical SMILES for N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide is CC1CC1CN(C)C(=O)c1ccc2nc[nH]c2c1.
What is the InChIKey of N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide?
The InChIKey is QUFPIQRQCSCSGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-9-5-11(9)7-17(2)14(18)10-3-4-12-13(6-10)16-8-15-12/h3-4,6,8-9,11H,5,7H2,1-2H3,(H,15,16).
What are the key properties of N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide?
N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide has a molecular weight of 243.31 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-methylcyclopropyl)methyl]-3H-benzimidazole-5-carboxamide is sourced from PubChem (CID 63860629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).