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

C9H18N2O2 — CID 50988968

IUPACN-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide
SMILESCN(CCO)C(=O)C1CCCNC1
InChIInChI=1S/C9H18N2O2/c1-11(5-6-12)9(13)8-3-2-4-10-7-8/h8,10,12H,2-7H2,1H3
InChIKeyMEBVYJXIKKBIMK-UHFFFAOYSA-N
MW186.25 g/mol
LogP-0.56
Rot. Bonds3

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

N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide (PubChem CID 50988968) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide
PubChem CID50988968
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC NameN-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide
SMILESCN(CCO)C(=O)C1CCCNC1
InChIInChI=1S/C9H18N2O2/c1-11(5-6-12)9(13)8-3-2-4-10-7-8/h8,10,12H,2-7H2,1H3
InChIKeyMEBVYJXIKKBIMK-UHFFFAOYSA-N
XLogP-0.56
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 5-0.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide (CID 50988968) is N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide is CN(CCO)C(=O)C1CCCNC1.
What is the InChIKey of N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide?
The InChIKey is MEBVYJXIKKBIMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-11(5-6-12)9(13)8-3-2-4-10-7-8/h8,10,12H,2-7H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide?
N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide has a molecular weight of 186.25 g/mol, XLogP of -0.56, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 50988968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).