N,N-diethyl-1-formylpiperidine-2-carboxamide

C11H20N2O2 — CID 87627372

IUPACN,N-diethyl-1-formylpiperidine-2-carboxamide
SMILESCCN(CC)C(=O)C1CCCCN1C=O
InChIInChI=1S/C11H20N2O2/c1-3-12(4-2)11(15)10-7-5-6-8-13(10)9-14/h9-10H,3-8H2,1-2H3
InChIKeyPZEFMEFDCNSWHR-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.87
Rot. Bonds4

About N,N-diethyl-1-formylpiperidine-2-carboxamide

N,N-diethyl-1-formylpiperidine-2-carboxamide (PubChem CID 87627372) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is N,N-diethyl-1-formylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-1-formylpiperidine-2-carboxamide
PubChem CID87627372
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC NameN,N-diethyl-1-formylpiperidine-2-carboxamide
SMILESCCN(CC)C(=O)C1CCCCN1C=O
InChIInChI=1S/C11H20N2O2/c1-3-12(4-2)11(15)10-7-5-6-8-13(10)9-14/h9-10H,3-8H2,1-2H3
InChIKeyPZEFMEFDCNSWHR-UHFFFAOYSA-N
XLogP0.87
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-formylpiperidine-2-carboxamide?
The IUPAC name of N,N-diethyl-1-formylpiperidine-2-carboxamide (CID 87627372) is N,N-diethyl-1-formylpiperidine-2-carboxamide.
What is the SMILES notation for N,N-diethyl-1-formylpiperidine-2-carboxamide?
The canonical SMILES for N,N-diethyl-1-formylpiperidine-2-carboxamide is CCN(CC)C(=O)C1CCCCN1C=O.
What is the InChIKey of N,N-diethyl-1-formylpiperidine-2-carboxamide?
The InChIKey is PZEFMEFDCNSWHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-3-12(4-2)11(15)10-7-5-6-8-13(10)9-14/h9-10H,3-8H2,1-2H3.
What are the key properties of N,N-diethyl-1-formylpiperidine-2-carboxamide?
N,N-diethyl-1-formylpiperidine-2-carboxamide has a molecular weight of 212.29 g/mol, XLogP of 0.87, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-formylpiperidine-2-carboxamide is sourced from PubChem (CID 87627372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).