1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine

C15H30N2 — CID 63243077

IUPAC1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
SMILESCC1CCC(CNCC2CCN(C)CC2)CC1
InChIInChI=1S/C15H30N2/c1-13-3-5-14(6-4-13)11-16-12-15-7-9-17(2)10-8-15/h13-16H,3-12H2,1-2H3
InChIKeyXYHSFSJZUJQZPX-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.74
Rot. Bonds4

About 1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine

1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine (PubChem CID 63243077) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine.

Molecular Properties

Compound Name1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
PubChem CID63243077
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
SMILESCC1CCC(CNCC2CCN(C)CC2)CC1
InChIInChI=1S/C15H30N2/c1-13-3-5-14(6-4-13)11-16-12-15-7-9-17(2)10-8-15/h13-16H,3-12H2,1-2H3
InChIKeyXYHSFSJZUJQZPX-UHFFFAOYSA-N
XLogP2.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine?
The IUPAC name of 1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine (CID 63243077) is 1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine.
What is the SMILES notation for 1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine?
The canonical SMILES for 1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine is CC1CCC(CNCC2CCN(C)CC2)CC1.
What is the InChIKey of 1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine?
The InChIKey is XYHSFSJZUJQZPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-13-3-5-14(6-4-13)11-16-12-15-7-9-17(2)10-8-15/h13-16H,3-12H2,1-2H3.
What are the key properties of 1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine?
1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine has a molecular weight of 238.42 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylcyclohexyl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine is sourced from PubChem (CID 63243077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).