[1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine

C16H32N2 — CID 113310568

IUPAC[1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine
SMILESCC1CCC(CN)(CN2C(C)CCCC2C)CC1
InChIInChI=1S/C16H32N2/c1-13-7-9-16(11-17,10-8-13)12-18-14(2)5-4-6-15(18)3/h13-15H,4-12,17H2,1-3H3
InChIKeyHZRWWGDAVSKKPR-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.40
Rot. Bonds3

About [1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine

[1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine (PubChem CID 113310568) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is [1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine.

Molecular Properties

Compound Name[1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine
PubChem CID113310568
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name[1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine
SMILESCC1CCC(CN)(CN2C(C)CCCC2C)CC1
InChIInChI=1S/C16H32N2/c1-13-7-9-16(11-17,10-8-13)12-18-14(2)5-4-6-15(18)3/h13-15H,4-12,17H2,1-3H3
InChIKeyHZRWWGDAVSKKPR-UHFFFAOYSA-N
XLogP3.40
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]cyclopropyl]methanamine
CID 104967782
[1-[(2,6-dimethylpiperidin-1-yl)methyl]cycloheptyl]methanamine
CID 115444989
[1-[[(2S,6R)-2,6-dimethylpiperidin-1-yl]methyl]cyclopropyl]methanethiol
CID 104969264
N-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]cyclobutanamine
CID 115442724
[1-[(3,4-dimethoxypyrrolidin-1-yl)methyl]-4-methylcyclohexyl]methanamine
CID 103534951
[1-[(2-methylpyrrolidin-1-yl)methyl]cyclobutyl]methanamine
CID 115448882
[1-[(2-methylpiperidin-1-yl)methyl]cyclobutyl]methanamine
CID 82171577
[4-methyl-1-[(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)methyl]cyclohexyl]methanamine
CID 102884207
[4-methyl-1-(methylaminomethyl)cyclohexyl]methanamine
CID 115442703
[1-[[3-(methoxymethyl)piperidin-1-yl]methyl]-4-methylcyclohexyl]methanamine
CID 106587463
[1-[[1-(aminomethyl)-4-methylcyclohexyl]methyl]-3-methylpyrrolidin-2-yl]methanol
CID 102789457
3-[(2R,6S)-2,6-dimethylpiperidin-1-yl]propan-1-amine
CID 7176132

Frequently Asked Questions

What is the IUPAC name of [1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine?
The IUPAC name of [1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine (CID 113310568) is [1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine.
What is the SMILES notation for [1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine?
The canonical SMILES for [1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine is CC1CCC(CN)(CN2C(C)CCCC2C)CC1.
What is the InChIKey of [1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine?
The InChIKey is HZRWWGDAVSKKPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-13-7-9-16(11-17,10-8-13)12-18-14(2)5-4-6-15(18)3/h13-15H,4-12,17H2,1-3H3.
What are the key properties of [1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine?
[1-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine has a molecular weight of 252.45 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-[(2,6-dimethylpiperidin-1-yl)methyl]-4-methylcyclohexyl]methanamine is sourced from PubChem (CID 113310568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).