4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine

C18H29NO — CID 63411885

IUPAC4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine
SMILESCC(C)Oc1ccc(C2(N)CCC(C(C)C)CC2)cc1
InChIInChI=1S/C18H29NO/c1-13(2)15-9-11-18(19,12-10-15)16-5-7-17(8-6-16)20-14(3)4/h5-8,13-15H,9-12,19H2,1-4H3
InChIKeyARSHZZRYPXRNFK-UHFFFAOYSA-N
MW275.44 g/mol
LogP4.47
Rot. Bonds4

About 4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine

4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine (PubChem CID 63411885) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is 4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine
PubChem CID63411885
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC Name4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine
SMILESCC(C)Oc1ccc(C2(N)CCC(C(C)C)CC2)cc1
InChIInChI=1S/C18H29NO/c1-13(2)15-9-11-18(19,12-10-15)16-5-7-17(8-6-16)20-14(3)4/h5-8,13-15H,9-12,19H2,1-4H3
InChIKeyARSHZZRYPXRNFK-UHFFFAOYSA-N
XLogP4.47
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-propan-2-yl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine
CID 55186583
1-(4-tert-butylphenyl)-4-propan-2-ylcyclohexan-1-amine
CID 63411290
3,5-dimethyl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine
CID 64751453
1-(4-ethoxyphenyl)-3-propan-2-ylcyclobutan-1-amine
CID 65016935
1-[3-fluoro-4-(trifluoromethyl)phenyl]-4-propan-2-ylcyclohexan-1-amine
CID 107288007
1-(5-methylthiophen-3-yl)-4-propan-2-ylcyclohexan-1-amine
CID 65099403
1-(4-methoxyphenyl)-4-propan-2-ylcyclohexan-1-ol
CID 55105917
1-(4-fluoro-3-methylphenyl)-4-propan-2-ylcycloheptan-1-amine
CID 65086228
1-(2,4-dimethoxyphenyl)-4-propan-2-ylcycloheptan-1-amine
CID 65086707
8-(4-propan-2-yloxyphenyl)tricyclo[5.2.1.02,6]decan-8-amine
CID 62795056
4-propan-2-yl-1-(3-propylphenyl)cyclohexan-1-amine
CID 116542991
8-methyl-3-(4-propan-2-yloxyphenyl)-8-azabicyclo[3.2.1]octan-3-ol
CID 171954809

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine?
The IUPAC name of 4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine (CID 63411885) is 4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine.
What is the SMILES notation for 4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine?
The canonical SMILES for 4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine is CC(C)Oc1ccc(C2(N)CCC(C(C)C)CC2)cc1.
What is the InChIKey of 4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine?
The InChIKey is ARSHZZRYPXRNFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO/c1-13(2)15-9-11-18(19,12-10-15)16-5-7-17(8-6-16)20-14(3)4/h5-8,13-15H,9-12,19H2,1-4H3.
What are the key properties of 4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine?
4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine has a molecular weight of 275.44 g/mol, XLogP of 4.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-1-(4-propan-2-yloxyphenyl)cyclohexan-1-amine is sourced from PubChem (CID 63411885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).