[1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine

C13H26N2 — CID 9079359

IUPAC[1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine
SMILESCC1CCN(C2(CN)CCCCC2)CC1
InChIInChI=1S/C13H26N2/c1-12-5-9-15(10-6-12)13(11-14)7-3-2-4-8-13/h12H,2-11,14H2,1H3
InChIKeyQBONHBWSWAFTTK-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.38
Rot. Bonds2

About [1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine

[1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine (PubChem CID 9079359) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is [1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine
PubChem CID9079359
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name[1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine
SMILESCC1CCN(C2(CN)CCCCC2)CC1
InChIInChI=1S/C13H26N2/c1-12-5-9-15(10-6-12)13(11-14)7-3-2-4-8-13/h12H,2-11,14H2,1H3
InChIKeyQBONHBWSWAFTTK-UHFFFAOYSA-N
XLogP2.38
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine?
The IUPAC name of [1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine (CID 9079359) is [1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine.
What is the SMILES notation for [1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine?
The canonical SMILES for [1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine is CC1CCN(C2(CN)CCCCC2)CC1.
What is the InChIKey of [1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine?
The InChIKey is QBONHBWSWAFTTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-12-5-9-15(10-6-12)13(11-14)7-3-2-4-8-13/h12H,2-11,14H2,1H3.
What are the key properties of [1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine?
[1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine has a molecular weight of 210.36 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methylpiperidin-1-yl)cyclohexyl]methanamine is sourced from PubChem (CID 9079359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).