2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine

C15H30N2 — CID 62610380

IUPAC2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine
SMILESCC1CCC(N)C(CN2CCC(C)CC2C)C1
InChIInChI=1S/C15H30N2/c1-11-4-5-15(16)14(9-11)10-17-7-6-12(2)8-13(17)3/h11-15H,4-10,16H2,1-3H3
InChIKeyGWWZYZDFLONWEB-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.87
Rot. Bonds2

About 2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine

2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine (PubChem CID 62610380) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine.

Molecular Properties

Compound Name2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine
PubChem CID62610380
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine
SMILESCC1CCC(N)C(CN2CCC(C)CC2C)C1
InChIInChI=1S/C15H30N2/c1-11-4-5-15(16)14(9-11)10-17-7-6-12(2)8-13(17)3/h11-15H,4-10,16H2,1-3H3
InChIKeyGWWZYZDFLONWEB-UHFFFAOYSA-N
XLogP2.87
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine?
The IUPAC name of 2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine (CID 62610380) is 2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine.
What is the SMILES notation for 2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine?
The canonical SMILES for 2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine is CC1CCC(N)C(CN2CCC(C)CC2C)C1.
What is the InChIKey of 2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine?
The InChIKey is GWWZYZDFLONWEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-11-4-5-15(16)14(9-11)10-17-7-6-12(2)8-13(17)3/h11-15H,4-10,16H2,1-3H3.
What are the key properties of 2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine?
2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine has a molecular weight of 238.42 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,4-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-amine is sourced from PubChem (CID 62610380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).