[1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine

C18H36N2 — CID 107428917

IUPAC[1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine
SMILESCCC1CCCCN1C1(CN)CCCC(CC(C)C)C1
InChIInChI=1S/C18H36N2/c1-4-17-9-5-6-11-20(17)18(14-19)10-7-8-16(13-18)12-15(2)3/h15-17H,4-14,19H2,1-3H3
InChIKeyCUKFWDXXJDRZLF-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.18
Rot. Bonds5

About [1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine

[1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine (PubChem CID 107428917) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is [1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine
PubChem CID107428917
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC Name[1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine
SMILESCCC1CCCCN1C1(CN)CCCC(CC(C)C)C1
InChIInChI=1S/C18H36N2/c1-4-17-9-5-6-11-20(17)18(14-19)10-7-8-16(13-18)12-15(2)3/h15-17H,4-14,19H2,1-3H3
InChIKeyCUKFWDXXJDRZLF-UHFFFAOYSA-N
XLogP4.18
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.50
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[4-ethyl-1-(2-ethylpiperidin-1-yl)cycloheptyl]methanamine
CID 65088511
[1-(2-ethylpyrrolidin-1-yl)-3-methylcyclohexyl]methanamine
CID 60974436
[1-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine
CID 107429063
[1-(3-ethylpyrrolidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine
CID 107429133
[1-(2-ethylpiperidin-1-yl)-3-(trifluoromethyl)cyclohexyl]methanamine
CID 64758210
[1-(2-ethylpiperidin-1-yl)-4-propan-2-ylcyclohexyl]methanamine
CID 63470394
[1-(4-ethyl-4-methylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine
CID 107429031
[3-(2-methylpropyl)-1-(3-methylpyrrolidin-1-yl)cyclohexyl]methanamine
CID 107428957
[3-(2-methylpropyl)-1-(4-propylpiperazin-1-yl)cyclohexyl]methanamine
CID 107428904
[1-(3,4-dimethylpyrrolidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine
CID 107429099
[4-(2-ethylpiperidin-1-yl)-1-methylpiperidin-4-yl]methanamine
CID 43266395
[1-(2-ethylpyrrolidin-1-yl)-3-propan-2-ylcyclobutyl]methanamine
CID 103562653

Frequently Asked Questions

What is the IUPAC name of [1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine?
The IUPAC name of [1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine (CID 107428917) is [1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine.
What is the SMILES notation for [1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine?
The canonical SMILES for [1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine is CCC1CCCCN1C1(CN)CCCC(CC(C)C)C1.
What is the InChIKey of [1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine?
The InChIKey is CUKFWDXXJDRZLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-4-17-9-5-6-11-20(17)18(14-19)10-7-8-16(13-18)12-15(2)3/h15-17H,4-14,19H2,1-3H3.
What are the key properties of [1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine?
[1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine has a molecular weight of 280.50 g/mol, XLogP of 4.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-ethylpiperidin-1-yl)-3-(2-methylpropyl)cyclohexyl]methanamine is sourced from PubChem (CID 107428917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).