N,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide

C15H17N3O — CID 110765996

IUPACN,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide
SMILESCn1c(C2CC2)nc2cc(C(=O)NC3CC3)ccc21
InChIInChI=1S/C15H17N3O/c1-18-13-7-4-10(15(19)16-11-5-6-11)8-12(13)17-14(18)9-2-3-9/h4,7-9,11H,2-3,5-6H2,1H3,(H,16,19)
InChIKeyIAVGVPAAHFYDLT-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.34
Rot. Bonds3

About N,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide

N,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide (PubChem CID 110765996) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is N,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide.

Molecular Properties

Compound NameN,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide
PubChem CID110765996
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC NameN,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide
SMILESCn1c(C2CC2)nc2cc(C(=O)NC3CC3)ccc21
InChIInChI=1S/C15H17N3O/c1-18-13-7-4-10(15(19)16-11-5-6-11)8-12(13)17-14(18)9-2-3-9/h4,7-9,11H,2-3,5-6H2,1H3,(H,16,19)
InChIKeyIAVGVPAAHFYDLT-UHFFFAOYSA-N
XLogP2.34
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-cyclopropyl-1-methylbenzimidazol-5-yl)-2-(ethylamino)ethanone
CID 96677034
N-cyclopentyl-1-methyl-2-propan-2-ylbenzimidazole-5-carboxamide
CID 110765952
N-[3-(cyclopropylcarbamoyl)phenyl]-1,2-dimethylbenzimidazole-5-carboxamide
CID 71881118
(2-cyclopentyl-1-methylbenzimidazol-5-yl)-cyclopropylmethanone
CID 82501905
N-cyclopropyl-1-methylbenzimidazole-5-carboxamide
CID 95967858
3-acetamido-N-(2-cyclopropyl-1-methylbenzimidazol-5-yl)benzamide
CID 110793284
4-(2-cyclopropyl-1-methylbenzimidazol-5-yl)butan-2-one
CID 82497246
N-benzyl-2-cyclopropyl-N,1-dimethylbenzimidazole-5-carboxamide
CID 110766019
2-(2-cyclopropyl-1-methylbenzimidazol-5-yl)propanoic acid
CID 82497559
N-cyclopentyl-1-methylbenzimidazole-5-carboxamide
CID 90980622
N-(3-hydroxycyclobutyl)-2-methoxy-1-methylbenzimidazole-5-carboxamide
CID 175044434
(E)-3-(2-cyclopropyl-1-methylbenzimidazol-5-yl)prop-2-enoic acid
CID 82497233

Frequently Asked Questions

What is the IUPAC name of N,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide?
The IUPAC name of N,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide (CID 110765996) is N,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide.
What is the SMILES notation for N,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide?
The canonical SMILES for N,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide is Cn1c(C2CC2)nc2cc(C(=O)NC3CC3)ccc21.
What is the InChIKey of N,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide?
The InChIKey is IAVGVPAAHFYDLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-18-13-7-4-10(15(19)16-11-5-6-11)8-12(13)17-14(18)9-2-3-9/h4,7-9,11H,2-3,5-6H2,1H3,(H,16,19).
What are the key properties of N,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide?
N,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide has a molecular weight of 255.32 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dicyclopropyl-1-methylbenzimidazole-5-carboxamide is sourced from PubChem (CID 110765996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).