4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine

C18H35N — CID 11832341

IUPAC4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine
SMILESCC(C)C1CCC(NC2CCC(C(C)C)CC2)CC1
InChIInChI=1S/C18H35N/c1-13(2)15-5-9-17(10-6-15)19-18-11-7-16(8-12-18)14(3)4/h13-19H,5-12H2,1-4H3
InChIKeyIATYAZHZDVKQQC-UHFFFAOYSA-N
MW265.48 g/mol
LogP5.01
Rot. Bonds4

About 4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine

4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine (PubChem CID 11832341) has the molecular formula C18H35N and a molecular weight of 265.48 g/mol. Its IUPAC name is 4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine
PubChem CID11832341
Molecular FormulaC18H35N
Molecular Weight265.48 g/mol
Exact Mass265.28
IUPAC Name4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine
SMILESCC(C)C1CCC(NC2CCC(C(C)C)CC2)CC1
InChIInChI=1S/C18H35N/c1-13(2)15-5-9-17(10-6-15)19-18-11-7-16(8-12-18)14(3)4/h13-19H,5-12H2,1-4H3
InChIKeyIATYAZHZDVKQQC-UHFFFAOYSA-N
XLogP5.01
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500265.48
LogP ≤ 55.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Perhexiline
CID 4746
4,4'-Methylenebis(N-sec-butylcyclohexamine)
CID 21885336
Perhexiline, (S)-
CID 6604329
4-tert-butyl-N-methylcyclohexan-1-amine
CID 15921596
4-tert-butyl-N-propan-2-ylcyclohexan-1-amine
CID 9120262
Perhexiline, (R)-
CID 38988177
N'-[3-(1,3-dicyclohexylpropan-2-ylamino)propyl]propane-1,3-diamine;hydrochloride
CID 90674828
N'-[3-(1,5-dicyclohexylpentan-3-ylamino)propyl]propane-1,3-diamine;hydrochloride
CID 90674830
N'-[3-(1,7-dicyclohexylheptan-4-ylamino)propyl]propane-1,3-diamine;hydrochloride
CID 90674831
N'-[3-(1,9-dicyclohexylnonan-5-ylamino)propyl]propane-1,3-diamine;hydrochloride
CID 90674832
N'-[2-(1,5-dicyclohexylpentan-3-ylamino)ethyl]ethane-1,2-diamine;hydrochloride
CID 90674834
N'-[3-[1,5-dicyclohexylpentan-3-yl(methyl)amino]propyl]propane-1,3-diamine;hydrochloride
CID 90674839

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine?
The IUPAC name of 4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine (CID 11832341) is 4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine.
What is the SMILES notation for 4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine?
The canonical SMILES for 4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine is CC(C)C1CCC(NC2CCC(C(C)C)CC2)CC1.
What is the InChIKey of 4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine?
The InChIKey is IATYAZHZDVKQQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N/c1-13(2)15-5-9-17(10-6-15)19-18-11-7-16(8-12-18)14(3)4/h13-19H,5-12H2,1-4H3.
What are the key properties of 4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine?
4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine has a molecular weight of 265.48 g/mol, XLogP of 5.01, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-N-(4-propan-2-ylcyclohexyl)cyclohexan-1-amine is sourced from PubChem (CID 11832341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).