N-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine

C17H23N3 — CID 106575351

IUPACN-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine
SMILESCC1CC(C)CC(Nc2nccn2-c2ccccc2)C1
InChIInChI=1S/C17H23N3/c1-13-10-14(2)12-15(11-13)19-17-18-8-9-20(17)16-6-4-3-5-7-16/h3-9,13-15H,10-12H2,1-2H3,(H,18,19)
InChIKeyBMRDXCZFKOBYOO-UHFFFAOYSA-N
MW269.39 g/mol
LogP4.11
Rot. Bonds3

About N-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine

N-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine (PubChem CID 106575351) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine.

Molecular Properties

Compound NameN-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine
PubChem CID106575351
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC NameN-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine
SMILESCC1CC(C)CC(Nc2nccn2-c2ccccc2)C1
InChIInChI=1S/C17H23N3/c1-13-10-14(2)12-15(11-13)19-17-18-8-9-20(17)16-6-4-3-5-7-16/h3-9,13-15H,10-12H2,1-2H3,(H,18,19)
InChIKeyBMRDXCZFKOBYOO-UHFFFAOYSA-N
XLogP4.11
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-1-phenylimidazol-2-amine
CID 106561276
N-(1-phenylimidazol-2-yl)piperidin-4-amine
CID 115044800
1-ethyl-N-(1-phenylimidazol-2-yl)piperidin-3-amine
CID 106565174
N-(2-methoxycyclopentyl)-1-phenylimidazol-2-amine
CID 106569919
N-(2,2-dimethylcyclohexyl)-1-phenylimidazol-2-amine
CID 106576686
N-cyclopentyl-1-(3-methylphenyl)imidazol-2-amine
CID 106560185
N-(2-methylphenyl)-1-phenylimidazol-2-amine
CID 106560579
1-(4-butylphenyl)-N-cyclopropylimidazol-2-amine
CID 106561505
N-cyclopentyl-1-(3-ethylphenyl)imidazol-2-amine
CID 106559803
N-cyclopentyl-1-(3-iodophenyl)imidazol-2-amine
CID 106554214
N-cyclopropyl-1-(4-ethoxyphenyl)imidazol-2-amine
CID 106555769
N-cyclopentyl-1-(3-ethoxyphenyl)imidazol-2-amine
CID 106566737

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine?
The IUPAC name of N-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine (CID 106575351) is N-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine.
What is the SMILES notation for N-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine?
The canonical SMILES for N-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine is CC1CC(C)CC(Nc2nccn2-c2ccccc2)C1.
What is the InChIKey of N-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine?
The InChIKey is BMRDXCZFKOBYOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-13-10-14(2)12-15(11-13)19-17-18-8-9-20(17)16-6-4-3-5-7-16/h3-9,13-15H,10-12H2,1-2H3,(H,18,19).
What are the key properties of N-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine?
N-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine has a molecular weight of 269.39 g/mol, XLogP of 4.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylcyclohexyl)-1-phenylimidazol-2-amine is sourced from PubChem (CID 106575351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).