1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine

C18H28N2O — CID 64774458

IUPAC1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine
SMILESCC1CCC(Oc2ccccc2N2CCC(N)CC2)CC1
InChIInChI=1S/C18H28N2O/c1-14-6-8-16(9-7-14)21-18-5-3-2-4-17(18)20-12-10-15(19)11-13-20/h2-5,14-16H,6-13,19H2,1H3
InChIKeyPCFNEZZBJGJQCE-UHFFFAOYSA-N
MW288.43 g/mol
LogP3.57
Rot. Bonds3

About 1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine

1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine (PubChem CID 64774458) has the molecular formula C18H28N2O and a molecular weight of 288.43 g/mol. Its IUPAC name is 1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine.

Molecular Properties

Compound Name1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine
PubChem CID64774458
Molecular FormulaC18H28N2O
Molecular Weight288.43 g/mol
Exact Mass288.22
IUPAC Name1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine
SMILESCC1CCC(Oc2ccccc2N2CCC(N)CC2)CC1
InChIInChI=1S/C18H28N2O/c1-14-6-8-16(9-7-14)21-18-5-3-2-4-17(18)20-12-10-15(19)11-13-20/h2-5,14-16H,6-13,19H2,1H3
InChIKeyPCFNEZZBJGJQCE-UHFFFAOYSA-N
XLogP3.57
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxyphenyl)piperidin-4-amine
CID 24708477
[2-(4-methylcyclohexyl)oxyphenyl]boronic acid
CID 64747344
1-[2-[3-(dimethylamino)propoxy]phenyl]piperidin-4-amine
CID 114526497
1-[2-(pyrimidin-2-ylmethoxy)phenyl]piperidin-4-amine
CID 62697897
1-[5-fluoro-2-(oxan-4-yloxy)phenyl]piperidin-4-amine
CID 63936921
1-[2-(3-methoxy-3-methylbutoxy)phenyl]piperidin-4-amine
CID 103036440
1-[2-(difluoromethoxy)phenyl]pyrrolidin-3-amine
CID 43315583
2-(4-aminocyclohexyl)oxyaniline
CID 117095465
1-[2-(4,4,4-trifluorobutoxy)phenyl]piperidin-4-amine
CID 115517958
4-[4-(2-methoxyphenyl)piperazin-1-yl]cyclohexan-1-amine
CID 10708578
1-(bromomethyl)-2-(4-methylcyclohexyl)oxybenzene
CID 64747332
1-(2-cycloheptyloxyphenyl)-1,4-diazepane
CID 82925695

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine?
The IUPAC name of 1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine (CID 64774458) is 1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine.
What is the SMILES notation for 1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine?
The canonical SMILES for 1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine is CC1CCC(Oc2ccccc2N2CCC(N)CC2)CC1.
What is the InChIKey of 1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine?
The InChIKey is PCFNEZZBJGJQCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-14-6-8-16(9-7-14)21-18-5-3-2-4-17(18)20-12-10-15(19)11-13-20/h2-5,14-16H,6-13,19H2,1H3.
What are the key properties of 1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine?
1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine has a molecular weight of 288.43 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-methylcyclohexyl)oxyphenyl]piperidin-4-amine is sourced from PubChem (CID 64774458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).