[4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine

C20H25NO — CID 24738284

IUPAC[4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine
SMILESCOc1ccc(C2CCC(C(N)c3ccccc3)CC2)cc1
InChIInChI=1S/C20H25NO/c1-22-19-13-11-16(12-14-19)15-7-9-18(10-8-15)20(21)17-5-3-2-4-6-17/h2-6,11-15,18,20H,7-10,21H2,1H3
InChIKeyZACKEEWTRYGOAK-UHFFFAOYSA-N
MW295.43 g/mol
LogP4.67
Rot. Bonds4

About [4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine

[4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine (PubChem CID 24738284) has the molecular formula C20H25NO and a molecular weight of 295.43 g/mol. Its IUPAC name is [4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine.

Molecular Properties

Compound Name[4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine
PubChem CID24738284
Molecular FormulaC20H25NO
Molecular Weight295.43 g/mol
Exact Mass295.19
IUPAC Name[4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine
SMILESCOc1ccc(C2CCC(C(N)c3ccccc3)CC2)cc1
InChIInChI=1S/C20H25NO/c1-22-19-13-11-16(12-14-19)15-7-9-18(10-8-15)20(21)17-5-3-2-4-6-17/h2-6,11-15,18,20H,7-10,21H2,1H3
InChIKeyZACKEEWTRYGOAK-UHFFFAOYSA-N
XLogP4.67
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-(4-methoxyphenyl)cyclohexyl]propan-1-amine
CID 126586754
1-[4-[4-(4-methoxyphenyl)cyclohexyl]cyclohexyl]propan-1-amine
CID 126539512
(4-cyclobutylphenyl)-(4-methoxyphenyl)methanamine
CID 116505877
1-methoxy-4-(3-phenylcyclobutyl)benzene
CID 125465439
1-methoxy-4-(4-methylcyclohexyl)benzene;hydrate
CID 144745908
(R)-cyclopropyl-(4-trimethylsilyloxyphenyl)methanamine
CID 171207318
cyclohexyl(phenyl)methanamine
CID 11064121
2-cyclohexyl-2-[4-(4-methoxyphenyl)cyclohexyl]acetamide
CID 142798976
(S)-cyclopropyl-(4-phenylmethoxyphenyl)methanamine
CID 171230786
(R)-cyclopropyl-(4-phenylmethoxyphenyl)methanamine
CID 171211184
(4-cyclobutylphenyl)-(3-methylcyclopentyl)methanamine
CID 116506220
bromomethane;1-cyclopentyl-4-methoxybenzene
CID 160663013

Frequently Asked Questions

What is the IUPAC name of [4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine?
The IUPAC name of [4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine (CID 24738284) is [4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine.
What is the SMILES notation for [4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine?
The canonical SMILES for [4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine is COc1ccc(C2CCC(C(N)c3ccccc3)CC2)cc1.
What is the InChIKey of [4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine?
The InChIKey is ZACKEEWTRYGOAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO/c1-22-19-13-11-16(12-14-19)15-7-9-18(10-8-15)20(21)17-5-3-2-4-6-17/h2-6,11-15,18,20H,7-10,21H2,1H3.
What are the key properties of [4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine?
[4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine has a molecular weight of 295.43 g/mol, XLogP of 4.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-methoxyphenyl)cyclohexyl]-phenylmethanamine is sourced from PubChem (CID 24738284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).