4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine

C15H23NO — CID 116962622

IUPAC4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine
SMILESCOc1c(C)cc(C2CCC(N)CC2)cc1C
InChIInChI=1S/C15H23NO/c1-10-8-13(9-11(2)15(10)17-3)12-4-6-14(16)7-5-12/h8-9,12,14H,4-7,16H2,1-3H3
InChIKeyZCKWKJCPDWFZRL-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.30
Rot. Bonds2

About 4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine

4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine (PubChem CID 116962622) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine
PubChem CID116962622
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine
SMILESCOc1c(C)cc(C2CCC(N)CC2)cc1C
InChIInChI=1S/C15H23NO/c1-10-8-13(9-11(2)15(10)17-3)12-4-6-14(16)7-5-12/h8-9,12,14H,4-7,16H2,1-3H3
InChIKeyZCKWKJCPDWFZRL-UHFFFAOYSA-N
XLogP3.30
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-aminocyclohexyl)-(4-methoxy-3,5-dimethylphenyl)methanone
CID 116917563
3-(4-methoxy-3,5-dimethylphenyl)pyrrolidine;hydrochloride
CID 169498562
(4-cyclopropyl-2,6-dimethylphenoxy)-dimethylsilane
CID 174561294
(2S)-2-(4-methoxy-3,5-dimethylphenyl)azetidine;hydrochloride
CID 171196939
3-(4-methoxy-2,3,5-trimethylphenyl)cyclobutan-1-amine
CID 116962770
(2R)-2-(4-methoxy-3,5-dimethylphenyl)pyrrolidine
CID 66518898
5-cyclopropyloxy-2-methoxy-1,3-dimethylbenzene
CID 130057399
1,3,5-tricyclopropylbenzene
CID 13056331
1-cyclopropyl-N-[(4-methoxy-3,5-dimethylphenyl)methyl]methanamine;hydrochloride
CID 115592095
3-[amino-(4-methoxy-3,5-dimethylphenyl)methyl]cyclobutan-1-amine
CID 116937420
(2S)-2-(4-methoxy-3,5-dimethylphenyl)piperidine;hydrochloride
CID 171195127
4-[(2,5-dimethoxy-4-methylphenyl)methyl]cyclohexan-1-amine
CID 116926249

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine?
The IUPAC name of 4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine (CID 116962622) is 4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine.
What is the SMILES notation for 4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine?
The canonical SMILES for 4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine is COc1c(C)cc(C2CCC(N)CC2)cc1C.
What is the InChIKey of 4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine?
The InChIKey is ZCKWKJCPDWFZRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-10-8-13(9-11(2)15(10)17-3)12-4-6-14(16)7-5-12/h8-9,12,14H,4-7,16H2,1-3H3.
What are the key properties of 4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine?
4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine has a molecular weight of 233.35 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxy-3,5-dimethylphenyl)cyclohexan-1-amine is sourced from PubChem (CID 116962622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).