(3R)-piperidine-3-carboxamide

C6H12N2O — CID 854158

IUPAC(3R)-piperidine-3-carboxamide
SMILESNC(=O)[C@@H]1CCCNC1
InChIInChI=1S/C6H12N2O/c7-6(9)5-2-1-3-8-4-5/h5,8H,1-4H2,(H2,7,9)/t5-/m1/s1
InChIKeyBVOCPVIXARZNQN-RXMQYKEDSA-N
MW128.18 g/mol
LogP-0.53
Rot. Bonds1

About (3R)-piperidine-3-carboxamide

(3R)-piperidine-3-carboxamide (PubChem CID 854158) has the molecular formula C6H12N2O and a molecular weight of 128.18 g/mol. Its IUPAC name is (3R)-piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-piperidine-3-carboxamide
PubChem CID854158
Molecular FormulaC6H12N2O
Molecular Weight128.18 g/mol
Exact Mass128.09
IUPAC Name(3R)-piperidine-3-carboxamide
SMILESNC(=O)[C@@H]1CCCNC1
InChIInChI=1S/C6H12N2O/c7-6(9)5-2-1-3-8-4-5/h5,8H,1-4H2,(H2,7,9)/t5-/m1/s1
InChIKeyBVOCPVIXARZNQN-RXMQYKEDSA-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 (3R)-piperidine-3-carboxamide?
The IUPAC name of (3R)-piperidine-3-carboxamide (CID 854158) is (3R)-piperidine-3-carboxamide.
What is the SMILES notation for (3R)-piperidine-3-carboxamide?
The canonical SMILES for (3R)-piperidine-3-carboxamide is NC(=O)[C@@H]1CCCNC1.
What is the InChIKey of (3R)-piperidine-3-carboxamide?
The InChIKey is BVOCPVIXARZNQN-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H12N2O/c7-6(9)5-2-1-3-8-4-5/h5,8H,1-4H2,(H2,7,9)/t5-/m1/s1.
What are the key properties of (3R)-piperidine-3-carboxamide?
(3R)-piperidine-3-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 (3R)-piperidine-3-carboxamide is sourced from PubChem (CID 854158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).