N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine

C12H15N3 — CID 115143834

IUPACN-cyclobutyl-N-methyl-1H-benzimidazol-2-amine
SMILESCN(c1nc2ccccc2[nH]1)C1CCC1
InChIInChI=1S/C12H15N3/c1-15(9-5-4-6-9)12-13-10-7-2-3-8-11(10)14-12/h2-3,7-9H,4-6H2,1H3,(H,13,14)
InChIKeyNXZQOWKIESGSLP-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.55
Rot. Bonds2

About N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine

N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine (PubChem CID 115143834) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine.

Molecular Properties

Compound NameN-cyclobutyl-N-methyl-1H-benzimidazol-2-amine
PubChem CID115143834
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC NameN-cyclobutyl-N-methyl-1H-benzimidazol-2-amine
SMILESCN(c1nc2ccccc2[nH]1)C1CCC1
InChIInChI=1S/C12H15N3/c1-15(9-5-4-6-9)12-13-10-7-2-3-8-11(10)14-12/h2-3,7-9H,4-6H2,1H3,(H,13,14)
InChIKeyNXZQOWKIESGSLP-UHFFFAOYSA-N
XLogP2.55
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dimethyl-1H-benzimidazol-2-amine
CID 17846
N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine
CID 90287555
N-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine
CID 115143924
N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N-methyl-1H-benzimidazol-2-amine
CID 126918903
N-(7,7-dimethyl-2-oxabicyclo[3.2.0]heptan-6-yl)-N-methyl-1H-benzimidazol-2-amine
CID 133410411
4-[bis(1H-benzimidazol-2-yl)amino]cyclohexan-1-one
CID 138676470
N-methyl-N-(piperidin-4-ylmethyl)-1H-benzimidazol-2-amine;hydrochloride
CID 71642448
N-(1-methylpyrrolidin-3-yl)-N-propyl-1H-benzimidazol-2-amine
CID 19819739
3-[[cyclohexyl(methyl)amino]methyl]-1H-quinoxalin-2-one
CID 86774445
6-[5-(4-chlorophenyl)-2-pyridinyl]-N-cyclopentyl-N-methyl-1H-benzimidazol-2-amine
CID 71022889
N-(2-chloropropyl)-N-methyl-1H-benzimidazol-2-amine
CID 63392162
N-(1H-benzimidazol-2-ylmethyl)-N-methylazepan-4-amine
CID 107173191

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine?
The IUPAC name of N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine (CID 115143834) is N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine.
What is the SMILES notation for N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine?
The canonical SMILES for N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine is CN(c1nc2ccccc2[nH]1)C1CCC1.
What is the InChIKey of N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine?
The InChIKey is NXZQOWKIESGSLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-15(9-5-4-6-9)12-13-10-7-2-3-8-11(10)14-12/h2-3,7-9H,4-6H2,1H3,(H,13,14).
What are the key properties of N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine?
N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine has a molecular weight of 201.27 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine is sourced from PubChem (CID 115143834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).