1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine

C14H19N3 — CID 103868174

IUPAC1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine
SMILESCCCC1CC1Nc1nc2ccccc2n1C
InChIInChI=1S/C14H19N3/c1-3-6-10-9-12(10)16-14-15-11-7-4-5-8-13(11)17(14)2/h4-5,7-8,10,12H,3,6,9H2,1-2H3,(H,15,16)
InChIKeyXBRDPNLXFDACHQ-UHFFFAOYSA-N
MW229.33 g/mol
LogP3.17
Rot. Bonds4

About 1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine

1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine (PubChem CID 103868174) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine.

Molecular Properties

Compound Name1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine
PubChem CID103868174
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine
SMILESCCCC1CC1Nc1nc2ccccc2n1C
InChIInChI=1S/C14H19N3/c1-3-6-10-9-12(10)16-14-15-11-7-4-5-8-13(11)17(14)2/h4-5,7-8,10,12H,3,6,9H2,1-2H3,(H,15,16)
InChIKeyXBRDPNLXFDACHQ-UHFFFAOYSA-N
XLogP3.17
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-N-(3-methylcyclopentyl)benzimidazol-2-amine
CID 114547792
N-cyclopentyl-1-methylbenzimidazol-2-amine
CID 923815
N-(2-cyclopropyloxolan-3-yl)-1-methylbenzimidazol-2-amine
CID 103868382
1-methyl-3-[(1-methylbenzimidazol-2-yl)amino]pyrrolidin-2-one
CID 113341915
N-[(1-methylbenzimidazol-2-yl)methyl]-4-propylcyclohexan-1-amine
CID 60665222
N-(3-cyclopentylpropyl)-1-methylbenzimidazol-2-amine
CID 106012665
4-butyl-N-(1-methylbenzimidazol-2-yl)cyclohexane-1-carboxamide
CID 3346804
N-(2-benzylpiperidin-4-yl)-1-methylbenzimidazol-2-amine
CID 18687492
1-methyl-5-[(1-methylbenzimidazol-2-yl)amino]piperidin-2-one
CID 64669796
2-[(1-methylbenzimidazol-2-yl)amino]ethanethiol
CID 21226750
N-[(1-cyclopropylcyclopropyl)methyl]-1-methylbenzimidazol-2-amine
CID 103868357
1,3-dimethyl-N-(1-methylbenzimidazol-2-yl)benzimidazol-2-imine
CID 58672187

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine?
The IUPAC name of 1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine (CID 103868174) is 1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine.
What is the SMILES notation for 1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine?
The canonical SMILES for 1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine is CCCC1CC1Nc1nc2ccccc2n1C.
What is the InChIKey of 1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine?
The InChIKey is XBRDPNLXFDACHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-3-6-10-9-12(10)16-14-15-11-7-4-5-8-13(11)17(14)2/h4-5,7-8,10,12H,3,6,9H2,1-2H3,(H,15,16).
What are the key properties of 1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine?
1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine has a molecular weight of 229.33 g/mol, XLogP of 3.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-propylcyclopropyl)benzimidazol-2-amine is sourced from PubChem (CID 103868174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).