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

C11H22N2O2 — CID 63131049

IUPAC3-ethyl-N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide
SMILESCCC1(C(=O)N(C)CCO)CCCNC1
InChIInChI=1S/C11H22N2O2/c1-3-11(5-4-6-12-9-11)10(15)13(2)7-8-14/h12,14H,3-9H2,1-2H3
InChIKeyPAIIRMFUVNWSHA-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.22
Rot. Bonds4

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

3-ethyl-N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide (PubChem CID 63131049) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 3-ethyl-N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide
PubChem CID63131049
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC Name3-ethyl-N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide
SMILESCCC1(C(=O)N(C)CCO)CCCNC1
InChIInChI=1S/C11H22N2O2/c1-3-11(5-4-6-12-9-11)10(15)13(2)7-8-14/h12,14H,3-9H2,1-2H3
InChIKeyPAIIRMFUVNWSHA-UHFFFAOYSA-N
XLogP0.22
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.22
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-hydroxyethyl)-N-methylpiperidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide (CID 63131049) is 3-ethyl-N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide is CCC1(C(=O)N(C)CCO)CCCNC1.
What is the InChIKey of 3-ethyl-N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide?
The InChIKey is PAIIRMFUVNWSHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-3-11(5-4-6-12-9-11)10(15)13(2)7-8-14/h12,14H,3-9H2,1-2H3.
What are the key properties of 3-ethyl-N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide?
3-ethyl-N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide has a molecular weight of 214.31 g/mol, XLogP of 0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 63131049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).