N-cyclooctyl-1H-benzimidazol-2-amine

C15H21N3 — CID 46784683

IUPACN-cyclooctyl-1H-benzimidazol-2-amine
SMILESc1ccc2[nH]c(NC3CCCCCCC3)nc2c1
InChIInChI=1S/C15H21N3/c1-2-4-8-12(9-5-3-1)16-15-17-13-10-6-7-11-14(13)18-15/h6-7,10-12H,1-5,8-9H2,(H2,16,17,18)
InChIKeyHNPJKLZRTMMCMX-UHFFFAOYSA-N
MW243.35 g/mol
LogP4.09
Rot. Bonds2

About N-cyclooctyl-1H-benzimidazol-2-amine

N-cyclooctyl-1H-benzimidazol-2-amine (PubChem CID 46784683) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is N-cyclooctyl-1H-benzimidazol-2-amine.

Molecular Properties

Compound NameN-cyclooctyl-1H-benzimidazol-2-amine
PubChem CID46784683
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC NameN-cyclooctyl-1H-benzimidazol-2-amine
SMILESc1ccc2[nH]c(NC3CCCCCCC3)nc2c1
InChIInChI=1S/C15H21N3/c1-2-4-8-12(9-5-3-1)16-15-17-13-10-6-7-11-14(13)18-15/h6-7,10-12H,1-5,8-9H2,(H2,16,17,18)
InChIKeyHNPJKLZRTMMCMX-UHFFFAOYSA-N
XLogP4.09
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3R)-piperidin-3-yl]-1H-benzimidazol-2-amine;hydrochloride
CID 71637322
N-[(3S)-piperidin-3-yl]-1H-benzimidazol-2-amine;hydrochloride
CID 71637361
4-(1H-benzimidazol-2-ylamino)cyclohexan-1-one
CID 138676689
1-(1H-benzimidazol-2-yl)-3-cyclohexylurea
CID 4159955
N-(cyclohexylmethyl)-1H-benzimidazol-2-amine
CID 18685672
N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1H-benzimidazol-2-amine
CID 25157552
4-(1H-benzimidazol-2-ylamino)-N-methylcyclohexane-1-carboxamide
CID 18732356
N-(2-methylsulfanylcyclopentyl)-1H-benzimidazol-2-amine
CID 113341923
N-[1-(1H-benzimidazol-2-yl)ethyl]cyclohexanamine
CID 53410318
N-cyclohexyl-1H-benzimidazole-2-sulfinamide
CID 156779597
N-(1H-benzimidazol-2-yl)bicyclo[4.1.0]heptane-7-carboxamide
CID 79140104
N-(piperidin-2-ylmethyl)-1H-benzimidazol-2-amine;hydrochloride
CID 71636788

Frequently Asked Questions

What is the IUPAC name of N-cyclooctyl-1H-benzimidazol-2-amine?
The IUPAC name of N-cyclooctyl-1H-benzimidazol-2-amine (CID 46784683) is N-cyclooctyl-1H-benzimidazol-2-amine.
What is the SMILES notation for N-cyclooctyl-1H-benzimidazol-2-amine?
The canonical SMILES for N-cyclooctyl-1H-benzimidazol-2-amine is c1ccc2[nH]c(NC3CCCCCCC3)nc2c1.
What is the InChIKey of N-cyclooctyl-1H-benzimidazol-2-amine?
The InChIKey is HNPJKLZRTMMCMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-2-4-8-12(9-5-3-1)16-15-17-13-10-6-7-11-14(13)18-15/h6-7,10-12H,1-5,8-9H2,(H2,16,17,18).
What are the key properties of N-cyclooctyl-1H-benzimidazol-2-amine?
N-cyclooctyl-1H-benzimidazol-2-amine has a molecular weight of 243.35 g/mol, XLogP of 4.09, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclooctyl-1H-benzimidazol-2-amine is sourced from PubChem (CID 46784683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).