1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine

C17H34N2 — CID 104746425

IUPAC1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine
SMILESCCNC(CN1CCCC(C)(C)C1)C1CCCCC1
InChIInChI=1S/C17H34N2/c1-4-18-16(15-9-6-5-7-10-15)13-19-12-8-11-17(2,3)14-19/h15-16,18H,4-14H2,1-3H3
InChIKeyCYNZJENNNPBGIP-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.67
Rot. Bonds5

About 1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine

1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine (PubChem CID 104746425) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine.

Molecular Properties

Compound Name1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine
PubChem CID104746425
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine
SMILESCCNC(CN1CCCC(C)(C)C1)C1CCCCC1
InChIInChI=1S/C17H34N2/c1-4-18-16(15-9-6-5-7-10-15)13-19-12-8-11-17(2,3)14-19/h15-16,18H,4-14H2,1-3H3
InChIKeyCYNZJENNNPBGIP-UHFFFAOYSA-N
XLogP3.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-2-(4,4-dimethylazepan-1-yl)-N-ethylethanamine
CID 104746542
1-cyclohexyl-N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)ethanamine
CID 107391751
1-cyclopentyl-2-(3,3-dimethylpyrrolidin-1-yl)-N-methylethanamine
CID 104746766
2-(3,3-dimethylpyrrolidin-1-yl)-N-ethyl-1-(oxolan-3-yl)ethanamine
CID 113448329
1-cyclohexyl-N-ethyl-2-(4-methylazepan-1-yl)ethanamine
CID 104746295
1-cyclohexyl-N-ethyl-2-(4-ethylazepan-1-yl)ethanamine
CID 104746455
1-cyclohexyl-2-(4-cyclopropylpiperazin-1-yl)-N-ethylethanamine
CID 104745275
1-[2-cyclohexyl-2-(ethylamino)ethyl]-N,N-dimethylpiperidin-3-amine
CID 104746634
1-[2-cyclohexyl-2-(ethylamino)ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 104746151
1-[2-cyclopentyl-2-(ethylamino)ethyl]-N,N-dimethylpiperidin-4-amine
CID 104744906
1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine
CID 104747000
1-[2-cyclohexyl-2-(ethylamino)ethyl]-N,N-diethylpyrrolidin-3-amine
CID 104746160

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine?
The IUPAC name of 1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine (CID 104746425) is 1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine.
What is the SMILES notation for 1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine?
The canonical SMILES for 1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine is CCNC(CN1CCCC(C)(C)C1)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine?
The InChIKey is CYNZJENNNPBGIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-4-18-16(15-9-6-5-7-10-15)13-19-12-8-11-17(2,3)14-19/h15-16,18H,4-14H2,1-3H3.
What are the key properties of 1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine?
1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine has a molecular weight of 266.47 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-(3,3-dimethylpiperidin-1-yl)-N-ethylethanamine is sourced from PubChem (CID 104746425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).