[1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine

C17H34N2 — CID 107449230

IUPAC[1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine
SMILESCC(C)C1CCCC(CN)(N2CCC(C)C(C)C2)C1
InChIInChI=1S/C17H34N2/c1-13(2)16-6-5-8-17(10-16,12-18)19-9-7-14(3)15(4)11-19/h13-16H,5-12,18H2,1-4H3
InChIKeyKFRIWCZUVWOAQP-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.51
Rot. Bonds3

About [1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine

[1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine (PubChem CID 107449230) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is [1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine
PubChem CID107449230
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name[1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine
SMILESCC(C)C1CCCC(CN)(N2CCC(C)C(C)C2)C1
InChIInChI=1S/C17H34N2/c1-13(2)16-6-5-8-17(10-16,12-18)19-9-7-14(3)15(4)11-19/h13-16H,5-12,18H2,1-4H3
InChIKeyKFRIWCZUVWOAQP-UHFFFAOYSA-N
XLogP3.51
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(4-ethylpiperazin-1-yl)-3-propan-2-ylcyclohexyl]methanamine
CID 107448927
[3-propan-2-yl-1-(2,2,6-trimethylmorpholin-4-yl)cyclohexyl]methanamine
CID 107449061
[3-cyclopropyl-1-(3,4-dimethylpyrrolidin-1-yl)cyclohexyl]methanamine
CID 79188405
[1-(3,4-dimethylpyrrolidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine
CID 107429099
[3-(2-methylpropyl)-1-(3-methylpyrrolidin-1-yl)cyclohexyl]methanamine
CID 107428957
[1-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-3-propan-2-ylcyclobutyl]methanamine
CID 103563040
1-[1-(aminomethyl)-3-methylcyclohexyl]-N,N-dimethylpyrrolidin-3-amine
CID 63166157
(2-methyl-1,2,3,5,6,7-hexahydropyrrolizin-8-yl)methanamine
CID 159003358
[3,5-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)cyclohexyl]methanamine
CID 103494626
[1-(4-methylazepan-1-yl)-4-propan-2-ylcyclohexyl]methanamine
CID 55248044
[1-methyl-4-(4-propan-2-ylpiperidin-1-yl)azepan-4-yl]methanamine
CID 103494627
[1-(4-methyl-1,4-diazepan-1-yl)-4-propan-2-ylcycloheptyl]methanamine
CID 65091393

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine?
The IUPAC name of [1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine (CID 107449230) is [1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine.
What is the SMILES notation for [1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine?
The canonical SMILES for [1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine is CC(C)C1CCCC(CN)(N2CCC(C)C(C)C2)C1.
What is the InChIKey of [1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine?
The InChIKey is KFRIWCZUVWOAQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-13(2)16-6-5-8-17(10-16,12-18)19-9-7-14(3)15(4)11-19/h13-16H,5-12,18H2,1-4H3.
What are the key properties of [1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine?
[1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine has a molecular weight of 266.47 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dimethylpiperidin-1-yl)-3-propan-2-ylcyclohexyl]methanamine is sourced from PubChem (CID 107449230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).