piperidine-4-carboxamide

C6H12N2O — CID 3772

IUPACpiperidine-4-carboxamide
SMILESNC(=O)C1CCNCC1
InChIInChI=1S/C6H12N2O/c7-6(9)5-1-3-8-4-2-5/h5,8H,1-4H2,(H2,7,9)
InChIKeyDPBWFNDFMCCGGJ-UHFFFAOYSA-N
MW128.18 g/mol
LogP-0.53
Rot. Bonds1

About piperidine-4-carboxamide

piperidine-4-carboxamide (PubChem CID 3772) has the molecular formula C6H12N2O and a molecular weight of 128.18 g/mol. Its IUPAC name is piperidine-4-carboxamide.

Molecular Properties

Compound Namepiperidine-4-carboxamide
PubChem CID3772
Molecular FormulaC6H12N2O
Molecular Weight128.18 g/mol
Exact Mass128.09
IUPAC Namepiperidine-4-carboxamide
SMILESNC(=O)C1CCNCC1
InChIInChI=1S/C6H12N2O/c7-6(9)5-1-3-8-4-2-5/h5,8H,1-4H2,(H2,7,9)
InChIKeyDPBWFNDFMCCGGJ-UHFFFAOYSA-N
XLogP-0.53
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.18
LogP ≤ 5-0.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of piperidine-4-carboxamide?
The IUPAC name of piperidine-4-carboxamide (CID 3772) is piperidine-4-carboxamide.
What is the SMILES notation for piperidine-4-carboxamide?
The canonical SMILES for piperidine-4-carboxamide is NC(=O)C1CCNCC1.
What is the InChIKey of piperidine-4-carboxamide?
The InChIKey is DPBWFNDFMCCGGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O/c7-6(9)5-1-3-8-4-2-5/h5,8H,1-4H2,(H2,7,9).
What are the key properties of piperidine-4-carboxamide?
piperidine-4-carboxamide has a molecular weight of 128.18 g/mol, XLogP of -0.53, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for piperidine-4-carboxamide is sourced from PubChem (CID 3772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).