1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine

C18H28N2 — CID 43215929

IUPAC1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine
SMILESCN1CCC(NC2CCC(c3ccccc3)CC2)CC1
InChIInChI=1S/C18H28N2/c1-20-13-11-18(12-14-20)19-17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-6,16-19H,7-14H2,1H3
InChIKeyFKLKBUCMBGJWAH-UHFFFAOYSA-N
MW272.44 g/mol
LogP3.40
Rot. Bonds3

About 1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine

1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine (PubChem CID 43215929) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is 1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine.

Molecular Properties

Compound Name1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine
PubChem CID43215929
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC Name1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine
SMILESCN1CCC(NC2CCC(c3ccccc3)CC2)CC1
InChIInChI=1S/C18H28N2/c1-20-13-11-18(12-14-20)19-17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-6,16-19H,7-14H2,1H3
InChIKeyFKLKBUCMBGJWAH-UHFFFAOYSA-N
XLogP3.40
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine?
The IUPAC name of 1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine (CID 43215929) is 1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine.
What is the SMILES notation for 1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine?
The canonical SMILES for 1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine is CN1CCC(NC2CCC(c3ccccc3)CC2)CC1.
What is the InChIKey of 1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine?
The InChIKey is FKLKBUCMBGJWAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2/c1-20-13-11-18(12-14-20)19-17-9-7-16(8-10-17)15-5-3-2-4-6-15/h2-6,16-19H,7-14H2,1H3.
What are the key properties of 1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine?
1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine has a molecular weight of 272.44 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(4-phenylcyclohexyl)piperidin-4-amine is sourced from PubChem (CID 43215929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).