2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine

C18H36N2 — CID 63495460

IUPAC2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine
SMILESCCC1CCC(N)C(CN2CCC(CC)(CC)CC2)C1
InChIInChI=1S/C18H36N2/c1-4-15-7-8-17(19)16(13-15)14-20-11-9-18(5-2,6-3)10-12-20/h15-17H,4-14,19H2,1-3H3
InChIKeyDRXIYSPLLZVUTG-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.04
Rot. Bonds5

About 2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine

2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine (PubChem CID 63495460) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is 2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine.

Molecular Properties

Compound Name2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine
PubChem CID63495460
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC Name2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine
SMILESCCC1CCC(N)C(CN2CCC(CC)(CC)CC2)C1
InChIInChI=1S/C18H36N2/c1-4-15-7-8-17(19)16(13-15)14-20-11-9-18(5-2,6-3)10-12-20/h15-17H,4-14,19H2,1-3H3
InChIKeyDRXIYSPLLZVUTG-UHFFFAOYSA-N
XLogP4.04
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 ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethyl-2-(pyrrolidin-1-ylmethyl)cyclohexan-1-amine
CID 62616060
4-ethyl-2-[(4-methylazepan-1-yl)methyl]cyclohexan-1-amine
CID 63623585
2-[[4-[(dimethylamino)methyl]piperidin-1-yl]methyl]-4-ethylcyclohexan-1-amine
CID 62609457
2-[(2,2-dimethylpyrrolidin-1-yl)methyl]-4-ethylcyclohexan-1-amine
CID 63218173
4-ethyl-2-[(3-ethylpiperidin-1-yl)methyl]cyclohexan-1-amine
CID 62616464
2-[(4-ethyl-4-methylpiperidin-1-yl)methyl]-4-propan-2-ylcyclohexan-1-amine
CID 63159689
2-[(4-ethylpiperidin-1-yl)methyl]cyclopentan-1-amine
CID 62609501
2-(2,3,3a,4,5,6,7,7a-octahydroindol-1-ylmethyl)-4-ethylcyclohexan-1-amine
CID 82751935
2-[(4,4-diethylpiperidin-1-yl)methyl]-N-methylcyclopentan-1-amine
CID 63160246
2-[(4,4-diethylpiperidin-1-yl)methyl]-N-ethylcyclohexan-1-amine
CID 63495462
2-[(4,4-dimethylazepan-1-yl)methyl]-4-methylcyclohexan-1-amine
CID 65281870
2-[1-[(2-amino-5-ethylcyclohexyl)methyl]piperidin-2-yl]ethanol
CID 55093548

Frequently Asked Questions

What is the IUPAC name of 2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine?
The IUPAC name of 2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine (CID 63495460) is 2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine.
What is the SMILES notation for 2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine?
The canonical SMILES for 2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine is CCC1CCC(N)C(CN2CCC(CC)(CC)CC2)C1.
What is the InChIKey of 2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine?
The InChIKey is DRXIYSPLLZVUTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-4-15-7-8-17(19)16(13-15)14-20-11-9-18(5-2,6-3)10-12-20/h15-17H,4-14,19H2,1-3H3.
What are the key properties of 2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine?
2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine has a molecular weight of 280.50 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4,4-diethylpiperidin-1-yl)methyl]-4-ethylcyclohexan-1-amine is sourced from PubChem (CID 63495460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).