3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide

C15H28N2O2 — CID 102632063

IUPAC3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide
SMILESCCC1(C(=O)N(C)C2CCCCC2O)CCCNC1
InChIInChI=1S/C15H28N2O2/c1-3-15(9-6-10-16-11-15)14(19)17(2)12-7-4-5-8-13(12)18/h12-13,16,18H,3-11H2,1-2H3
InChIKeyIODOBEQQYKVCGX-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.53
Rot. Bonds3

About 3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide

3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide (PubChem CID 102632063) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide
PubChem CID102632063
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide
SMILESCCC1(C(=O)N(C)C2CCCCC2O)CCCNC1
InChIInChI=1S/C15H28N2O2/c1-3-15(9-6-10-16-11-15)14(19)17(2)12-7-4-5-8-13(12)18/h12-13,16,18H,3-11H2,1-2H3
InChIKeyIODOBEQQYKVCGX-UHFFFAOYSA-N
XLogP1.53
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide (CID 102632063) is 3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide is CCC1(C(=O)N(C)C2CCCCC2O)CCCNC1.
What is the InChIKey of 3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide?
The InChIKey is IODOBEQQYKVCGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-3-15(9-6-10-16-11-15)14(19)17(2)12-7-4-5-8-13(12)18/h12-13,16,18H,3-11H2,1-2H3.
What are the key properties of 3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide?
3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide has a molecular weight of 268.40 g/mol, XLogP of 1.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(2-hydroxycyclohexyl)-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 102632063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).