3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine

C19H31N — CID 103961176

IUPAC3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine
SMILESCC(C)c1ccc(C2(N)CC(C)(C)CC(C)(C)C2)cc1
InChIInChI=1S/C19H31N/c1-14(2)15-7-9-16(10-8-15)19(20)12-17(3,4)11-18(5,6)13-19/h7-10,14H,11-13,20H2,1-6H3
InChIKeyRKGARPOUQRKBMB-UHFFFAOYSA-N
MW273.46 g/mol
LogP5.20
Rot. Bonds2

About 3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine

3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine (PubChem CID 103961176) has the molecular formula C19H31N and a molecular weight of 273.46 g/mol. Its IUPAC name is 3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine.

Molecular Properties

Compound Name3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine
PubChem CID103961176
Molecular FormulaC19H31N
Molecular Weight273.46 g/mol
Exact Mass273.25
IUPAC Name3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine
SMILESCC(C)c1ccc(C2(N)CC(C)(C)CC(C)(C)C2)cc1
InChIInChI=1S/C19H31N/c1-14(2)15-7-9-16(10-8-15)19(20)12-17(3,4)11-18(5,6)13-19/h7-10,14H,11-13,20H2,1-6H3
InChIKeyRKGARPOUQRKBMB-UHFFFAOYSA-N
XLogP5.20
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500273.46
LogP ≤ 55.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-chlorophenyl)-3,3-dimethylcyclobutan-1-amine
CID 65000826
1-(4-propan-2-ylphenyl)cyclobutan-1-amine
CID 43146614
1-(4-propan-2-ylphenyl)cyclopent-3-en-1-amine
CID 65353110
4-(1-amino-3,3-dimethylcyclobutyl)phenol
CID 115018738
3-(4-propan-2-ylphenyl)azetidin-3-amine;hydrochloride
CID 166607903
3,3-dimethyl-1-pyridin-4-ylcyclobutan-1-amine
CID 80524018
4-propan-2-yl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine
CID 55186583
[2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanamine
CID 83705516
3,3-dimethyl-1-(4-propan-2-ylphenyl)cyclopentan-1-ol
CID 80699700
3,3,5,5-tetramethyl-1-(6-methyl-3-pyridinyl)cyclohexan-1-amine
CID 103961175
[2,2-dimethyl-1-(4-propan-2-ylphenyl)cyclopropyl]methanol
CID 116842604
3,3-dimethyl-1-[(4-propan-2-ylphenyl)methyl]cyclopentan-1-amine
CID 80705541

Frequently Asked Questions

What is the IUPAC name of 3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine?
The IUPAC name of 3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine (CID 103961176) is 3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine.
What is the SMILES notation for 3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine?
The canonical SMILES for 3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine is CC(C)c1ccc(C2(N)CC(C)(C)CC(C)(C)C2)cc1.
What is the InChIKey of 3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine?
The InChIKey is RKGARPOUQRKBMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N/c1-14(2)15-7-9-16(10-8-15)19(20)12-17(3,4)11-18(5,6)13-19/h7-10,14H,11-13,20H2,1-6H3.
What are the key properties of 3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine?
3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine has a molecular weight of 273.46 g/mol, XLogP of 5.20, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,5,5-tetramethyl-1-(4-propan-2-ylphenyl)cyclohexan-1-amine is sourced from PubChem (CID 103961176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).