2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine

C14H19N3O — CID 102634417

IUPAC2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine
SMILESCNC1CCCCC1Oc1nc2ccccc2[nH]1
InChIInChI=1S/C14H19N3O/c1-15-12-8-4-5-9-13(12)18-14-16-10-6-2-3-7-11(10)17-14/h2-3,6-7,12-13,15H,4-5,8-9H2,1H3,(H,16,17)
InChIKeyCUSDRZDVPMMIDZ-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.47
Rot. Bonds3

About 2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine

2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine (PubChem CID 102634417) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine
PubChem CID102634417
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine
SMILESCNC1CCCCC1Oc1nc2ccccc2[nH]1
InChIInChI=1S/C14H19N3O/c1-15-12-8-4-5-9-13(12)18-14-16-10-6-2-3-7-11(10)17-14/h2-3,6-7,12-13,15H,4-5,8-9H2,1H3,(H,16,17)
InChIKeyCUSDRZDVPMMIDZ-UHFFFAOYSA-N
XLogP2.47
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(6-methoxy-2-pyridinyl)oxy]-N-methylcyclohexan-1-amine
CID 102634392
2-(1H-benzimidazol-2-yloxy)-1H-benzimidazole
CID 21195904
N-cyclooctyl-1H-benzimidazol-2-amine
CID 46784683
N-(2-methylsulfanylcyclopentyl)-1H-benzimidazol-2-amine
CID 113341923
2-methylsulfanyloxy-1H-benzimidazole
CID 118398780
trans-(1R,2R)-N-methyl-2-(4-methylphenoxy)cyclohexan-1-amine;hydrochloride
CID 24837203
2-[(6-fluoro-1H-benzimidazol-2-yl)oxy]cycloheptan-1-amine
CID 103295496
N-(cyclohexylmethyl)-1H-benzimidazol-2-amine
CID 18685672
2-[4-(3-cyclopropylpropyl)phenoxy]-1H-benzimidazole
CID 91340289
1-(1H-benzimidazol-2-yloxy)ethanol
CID 164970423
tert-butyl 3-(1H-benzimidazol-2-yloxy)pyrrolidine-1-carboxylate
CID 71629736
N-methyl-2-[[3-(trifluoromethyl)-2-pyridinyl]oxy]cyclohexan-1-amine
CID 102634719

Frequently Asked Questions

What is the IUPAC name of 2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine?
The IUPAC name of 2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine (CID 102634417) is 2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine.
What is the SMILES notation for 2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine?
The canonical SMILES for 2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine is CNC1CCCCC1Oc1nc2ccccc2[nH]1.
What is the InChIKey of 2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine?
The InChIKey is CUSDRZDVPMMIDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-15-12-8-4-5-9-13(12)18-14-16-10-6-2-3-7-11(10)17-14/h2-3,6-7,12-13,15H,4-5,8-9H2,1H3,(H,16,17).
What are the key properties of 2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine?
2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine has a molecular weight of 245.33 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-benzimidazol-2-yloxy)-N-methylcyclohexan-1-amine is sourced from PubChem (CID 102634417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).