N-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide

C10H19N3O2 — CID 3623770

IUPACN-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide
SMILESCN(C)CCNC(=O)C1CCCNC1=O
InChIInChI=1S/C10H19N3O2/c1-13(2)7-6-12-10(15)8-4-3-5-11-9(8)14/h8H,3-7H2,1-2H3,(H,11,14)(H,12,15)
InChIKeyZWLHBDSYBXQSFA-UHFFFAOYSA-N
MW213.28 g/mol
LogP-0.81
Rot. Bonds4

About N-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide

N-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide (PubChem CID 3623770) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide
PubChem CID3623770
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC NameN-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide
SMILESCN(C)CCNC(=O)C1CCCNC1=O
InChIInChI=1S/C10H19N3O2/c1-13(2)7-6-12-10(15)8-4-3-5-11-9(8)14/h8H,3-7H2,1-2H3,(H,11,14)(H,12,15)
InChIKeyZWLHBDSYBXQSFA-UHFFFAOYSA-N
XLogP-0.81
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 5-0.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide (CID 3623770) is N-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide is CN(C)CCNC(=O)C1CCCNC1=O.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide?
The InChIKey is ZWLHBDSYBXQSFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-13(2)7-6-12-10(15)8-4-3-5-11-9(8)14/h8H,3-7H2,1-2H3,(H,11,14)(H,12,15).
What are the key properties of N-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide?
N-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide has a molecular weight of 213.28 g/mol, XLogP of -0.81, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-oxopiperidine-3-carboxamide is sourced from PubChem (CID 3623770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).