N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide

C14H17N3O — CID 86792753

IUPACN,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide
SMILESCC1CC1C(=O)N(C)c1nc2ccccc2n1C
InChIInChI=1S/C14H17N3O/c1-9-8-10(9)13(18)17(3)14-15-11-6-4-5-7-12(11)16(14)2/h4-7,9-10H,8H2,1-3H3
InChIKeyVHVNIXDJXNEZLR-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.19
Rot. Bonds2

About N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide

N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide (PubChem CID 86792753) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide
PubChem CID86792753
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC NameN,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide
SMILESCC1CC1C(=O)N(C)c1nc2ccccc2n1C
InChIInChI=1S/C14H17N3O/c1-9-8-10(9)13(18)17(3)14-15-11-6-4-5-7-12(11)16(14)2/h4-7,9-10H,8H2,1-3H3
InChIKeyVHVNIXDJXNEZLR-UHFFFAOYSA-N
XLogP2.19
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-methylbenzimidazol-2-yl)-1-(2-methylcyclopropyl)ethanone
CID 79754172
N,1,5-trimethyl-N-(1-methylbenzimidazol-2-yl)pyrrole-2-carboxamide
CID 86792862
2-(cyclopropylmethoxy)-N-methyl-N-(1-methylbenzimidazol-2-yl)acetamide
CID 86792738
2-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxylic acid
CID 60792986
4-cyclopropyl-N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)pyrimidine-5-carboxamide
CID 136539953
N-methyl-N-(1-methylbenzimidazol-2-yl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 154736677
trans-(1S,2S)-N-(1,3-benzothiazol-2-yl)-N,2-dimethylcyclopropane-1-carboxamide
CID 34248200
N-methyl-N-(1-methylbenzimidazol-2-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine-3-carboxamide
CID 86792736
N-(cyclohexylmethyl)-N,1-dimethylbenzimidazol-2-amine
CID 115144037
N,1-dimethyl-N-phenylbenzimidazole-2-carboxamide
CID 110469037
(2S,3R)-N,2-dimethyl-N-[(1-methylbenzimidazol-2-yl)methyl]oxane-3-carboxamide
CID 129401690
5-[methyl-(1-methylbenzimidazol-2-yl)amino]pentan-1-ol
CID 107203489

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide?
The IUPAC name of N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide (CID 86792753) is N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide?
The canonical SMILES for N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide is CC1CC1C(=O)N(C)c1nc2ccccc2n1C.
What is the InChIKey of N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide?
The InChIKey is VHVNIXDJXNEZLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-9-8-10(9)13(18)17(3)14-15-11-6-4-5-7-12(11)16(14)2/h4-7,9-10H,8H2,1-3H3.
What are the key properties of N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide?
N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide has a molecular weight of 243.31 g/mol, XLogP of 2.19, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-(1-methylbenzimidazol-2-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 86792753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).