[4-(2,2-diphenylethyl)cyclohexyl]methanamine

C21H27N — CID 154511159

IUPAC[4-(2,2-diphenylethyl)cyclohexyl]methanamine
SMILESNCC1CCC(CC(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C21H27N/c22-16-18-13-11-17(12-14-18)15-21(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-10,17-18,21H,11-16,22H2
InChIKeyDHYGDZKESAXGLE-UHFFFAOYSA-N
MW293.45 g/mol
LogP4.97
Rot. Bonds5

About [4-(2,2-diphenylethyl)cyclohexyl]methanamine

[4-(2,2-diphenylethyl)cyclohexyl]methanamine (PubChem CID 154511159) has the molecular formula C21H27N and a molecular weight of 293.45 g/mol. Its IUPAC name is [4-(2,2-diphenylethyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[4-(2,2-diphenylethyl)cyclohexyl]methanamine
PubChem CID154511159
Molecular FormulaC21H27N
Molecular Weight293.45 g/mol
Exact Mass293.21
IUPAC Name[4-(2,2-diphenylethyl)cyclohexyl]methanamine
SMILESNCC1CCC(CC(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C21H27N/c22-16-18-13-11-17(12-14-18)15-21(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-10,17-18,21H,11-16,22H2
InChIKeyDHYGDZKESAXGLE-UHFFFAOYSA-N
XLogP4.97
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.45
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-cyclopentyl-1-phenylethyl)benzene
CID 138978826
[(2S)-1-cyclopropylpropan-2-yl]benzene
CID 169109278
[1-(2,2-diphenylethyl)pyrrolidin-3-yl]methanamine
CID 50982031
2-[4-(aminomethyl)piperidin-1-yl]-1-phenylethanol
CID 54592604
2-cycloheptyl-1-phenylethanamine
CID 21261900
2-cyclobutyl-1-phenylethanamine;hydrochloride
CID 131675142
N-[[4-(aminomethyl)cyclohexyl]methyl]-N-[(4-fluorophenyl)methyl]-2,2-diphenylethanamine
CID 23826295
[4-(aminomethyl)cyclohexyl]methanamine
CID 158172497
1-[4-(aminomethyl)cyclohexyl]propan-2-ol
CID 70069622
2-cyclopropyl-2-phenylethanamine;hydrochloride
CID 57365234
cyclopropylmethyl 3-amino-2-phenylpropanoate
CID 62878848
(1-tritylpiperidin-4-yl)methanamine
CID 18668757

Frequently Asked Questions

What is the IUPAC name of [4-(2,2-diphenylethyl)cyclohexyl]methanamine?
The IUPAC name of [4-(2,2-diphenylethyl)cyclohexyl]methanamine (CID 154511159) is [4-(2,2-diphenylethyl)cyclohexyl]methanamine.
What is the SMILES notation for [4-(2,2-diphenylethyl)cyclohexyl]methanamine?
The canonical SMILES for [4-(2,2-diphenylethyl)cyclohexyl]methanamine is NCC1CCC(CC(c2ccccc2)c2ccccc2)CC1.
What is the InChIKey of [4-(2,2-diphenylethyl)cyclohexyl]methanamine?
The InChIKey is DHYGDZKESAXGLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N/c22-16-18-13-11-17(12-14-18)15-21(19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-10,17-18,21H,11-16,22H2.
What are the key properties of [4-(2,2-diphenylethyl)cyclohexyl]methanamine?
[4-(2,2-diphenylethyl)cyclohexyl]methanamine has a molecular weight of 293.45 g/mol, XLogP of 4.97, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,2-diphenylethyl)cyclohexyl]methanamine is sourced from PubChem (CID 154511159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).