1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine

C14H19N3 — CID 113488927

IUPAC1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine
SMILESCCC1(n2c(N)nc3cc(C)ccc32)CCC1
InChIInChI=1S/C14H19N3/c1-3-14(7-4-8-14)17-12-6-5-10(2)9-11(12)16-13(17)15/h5-6,9H,3-4,7-8H2,1-2H3,(H2,15,16)
InChIKeyBTMBLPDVXMPIND-UHFFFAOYSA-N
MW229.33 g/mol
LogP3.22
Rot. Bonds2

About 1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine

1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine (PubChem CID 113488927) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine.

Molecular Properties

Compound Name1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine
PubChem CID113488927
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine
SMILESCCC1(n2c(N)nc3cc(C)ccc32)CCC1
InChIInChI=1S/C14H19N3/c1-3-14(7-4-8-14)17-12-6-5-10(2)9-11(12)16-13(17)15/h5-6,9H,3-4,7-8H2,1-2H3,(H2,15,16)
InChIKeyBTMBLPDVXMPIND-UHFFFAOYSA-N
XLogP3.22
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine 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

1-(1-ethylcyclobutyl)-6-fluoro-5-iodobenzimidazol-2-amine
CID 113488932
3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 113488928
5-methyl-1-piperidin-1-ylbenzimidazol-2-amine
CID 83019041
2-(2-chloroethyl)-1-(1-ethylcyclobutyl)-5-fluorobenzimidazole
CID 113488945
1-(cyclopentylmethyl)-5-methylbenzimidazol-2-amine
CID 43662072
1-[(1-cyclopropyl-5-methylbenzimidazol-2-yl)methyl]cyclobutan-1-amine
CID 79846795
1-(2-aminoethyl)-5-methylbenzimidazol-2-amine
CID 84771588
5-methyl-1-(2-pyrazol-1-ylethyl)benzimidazol-2-amine
CID 54951144
5-methyl-1-(1-methylsulfanylbutan-2-yl)benzimidazol-2-amine
CID 113494960
5-methyl-1-(2-morpholin-4-ylethyl)benzimidazol-2-amine
CID 43661563
1-(2-cyclopropylpropan-2-yl)-5-methylbenzimidazol-2-amine
CID 114111711
1-(4-butylphenyl)-5-methylbenzimidazol-2-amine
CID 43662088

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine?
The IUPAC name of 1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine (CID 113488927) is 1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine.
What is the SMILES notation for 1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine?
The canonical SMILES for 1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine is CCC1(n2c(N)nc3cc(C)ccc32)CCC1.
What is the InChIKey of 1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine?
The InChIKey is BTMBLPDVXMPIND-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-3-14(7-4-8-14)17-12-6-5-10(2)9-11(12)16-13(17)15/h5-6,9H,3-4,7-8H2,1-2H3,(H2,15,16).
What are the key properties of 1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine?
1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine has a molecular weight of 229.33 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylcyclobutyl)-5-methylbenzimidazol-2-amine is sourced from PubChem (CID 113488927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).