2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole

C14H18N2 — CID 103164535

IUPAC2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole
SMILESCCc1ccc2nc(CC3CCC3)[nH]c2c1
InChIInChI=1S/C14H18N2/c1-2-10-6-7-12-13(8-10)16-14(15-12)9-11-4-3-5-11/h6-8,11H,2-5,9H2,1H3,(H,15,16)
InChIKeyUHHVWAFBHYSRJU-UHFFFAOYSA-N
MW214.31 g/mol
LogP3.47
Rot. Bonds3

About 2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole

2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole (PubChem CID 103164535) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole.

Molecular Properties

Compound Name2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole
PubChem CID103164535
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC Name2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole
SMILESCCc1ccc2nc(CC3CCC3)[nH]c2c1
InChIInChI=1S/C14H18N2/c1-2-10-6-7-12-13(8-10)16-14(15-12)9-11-4-3-5-11/h6-8,11H,2-5,9H2,1H3,(H,15,16)
InChIKeyUHHVWAFBHYSRJU-UHFFFAOYSA-N
XLogP3.47
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(cyclohexylmethyl)-6-methyl-1H-benzimidazole
CID 10082509
2-(chloromethyl)-6-ethyl-1H-benzimidazole
CID 14096341
6-bromo-2-(cyclopentylmethyl)-1H-benzimidazole
CID 64723934
N-[(2-ethyl-3H-benzimidazol-5-yl)methyl]cyclobutanamine
CID 82495000
N-[2-(6-ethyl-1H-benzimidazol-2-yl)ethyl]cycloheptanamine
CID 82336949
2-(cyclohexylmethyl)-6-cyclopropyloxy-1H-benzimidazole
CID 138664980
[2-(thian-4-ylmethyl)-3H-benzimidazol-5-yl]methanamine
CID 83135372
6-chloro-2-(cyclopropylmethyl)-1H-benzimidazole
CID 64724517
2-(cyclopentylmethyl)-5,6-dimethyl-1H-benzimidazole
CID 60977974
6-ethyl-2-(2-methylbutyl)-1H-benzimidazole
CID 114875306
3-(6-ethyl-1H-benzimidazol-2-yl)propanoic acid
CID 79017254
N-[1-(6-ethyl-1H-benzimidazol-2-yl)ethyl]-N-methylcyclohexanamine
CID 82336177

Frequently Asked Questions

What is the IUPAC name of 2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole?
The IUPAC name of 2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole (CID 103164535) is 2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole.
What is the SMILES notation for 2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole?
The canonical SMILES for 2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole is CCc1ccc2nc(CC3CCC3)[nH]c2c1.
What is the InChIKey of 2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole?
The InChIKey is UHHVWAFBHYSRJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-2-10-6-7-12-13(8-10)16-14(15-12)9-11-4-3-5-11/h6-8,11H,2-5,9H2,1H3,(H,15,16).
What are the key properties of 2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole?
2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole has a molecular weight of 214.31 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclobutylmethyl)-6-ethyl-1H-benzimidazole is sourced from PubChem (CID 103164535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).