N-(2-piperidin-1-ylethyl)piperidine-3-carboxamide

C13H25N3O — CID 54967476

IUPACN-(2-piperidin-1-ylethyl)piperidine-3-carboxamide
SMILESO=C(NCCN1CCCCC1)C1CCCNC1
InChIInChI=1S/C13H25N3O/c17-13(12-5-4-6-14-11-12)15-7-10-16-8-2-1-3-9-16/h12,14H,1-11H2,(H,15,17)
InChIKeyGVXOGHVZMABGKF-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.59
Rot. Bonds4

About N-(2-piperidin-1-ylethyl)piperidine-3-carboxamide

N-(2-piperidin-1-ylethyl)piperidine-3-carboxamide (PubChem CID 54967476) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is N-(2-piperidin-1-ylethyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-piperidin-1-ylethyl)piperidine-3-carboxamide
PubChem CID54967476
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC NameN-(2-piperidin-1-ylethyl)piperidine-3-carboxamide
SMILESO=C(NCCN1CCCCC1)C1CCCNC1
InChIInChI=1S/C13H25N3O/c17-13(12-5-4-6-14-11-12)15-7-10-16-8-2-1-3-9-16/h12,14H,1-11H2,(H,15,17)
InChIKeyGVXOGHVZMABGKF-UHFFFAOYSA-N
XLogP0.59
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-1-ylethyl)piperidine-3-carboxamide?
The IUPAC name of N-(2-piperidin-1-ylethyl)piperidine-3-carboxamide (CID 54967476) is N-(2-piperidin-1-ylethyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(2-piperidin-1-ylethyl)piperidine-3-carboxamide?
The canonical SMILES for N-(2-piperidin-1-ylethyl)piperidine-3-carboxamide is O=C(NCCN1CCCCC1)C1CCCNC1.
What is the InChIKey of N-(2-piperidin-1-ylethyl)piperidine-3-carboxamide?
The InChIKey is GVXOGHVZMABGKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c17-13(12-5-4-6-14-11-12)15-7-10-16-8-2-1-3-9-16/h12,14H,1-11H2,(H,15,17).
What are the key properties of N-(2-piperidin-1-ylethyl)piperidine-3-carboxamide?
N-(2-piperidin-1-ylethyl)piperidine-3-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 0.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-1-ylethyl)piperidine-3-carboxamide is sourced from PubChem (CID 54967476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).