4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide

C13H20N4O2 — CID 71894008

IUPAC4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide
SMILESO=C(NCCNc1ccccn1)N1CCC(O)CC1
InChIInChI=1S/C13H20N4O2/c18-11-4-9-17(10-5-11)13(19)16-8-7-15-12-3-1-2-6-14-12/h1-3,6,11,18H,4-5,7-10H2,(H,14,15)(H,16,19)
InChIKeyJPYZFMOKDJRDFZ-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.66
Rot. Bonds4

About 4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide

4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide (PubChem CID 71894008) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is 4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide
PubChem CID71894008
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide
SMILESO=C(NCCNc1ccccn1)N1CCC(O)CC1
InChIInChI=1S/C13H20N4O2/c18-11-4-9-17(10-5-11)13(19)16-8-7-15-12-3-1-2-6-14-12/h1-3,6,11,18H,4-5,7-10H2,(H,14,15)(H,16,19)
InChIKeyJPYZFMOKDJRDFZ-UHFFFAOYSA-N
XLogP0.66
TPSA77.49 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide?
The IUPAC name of 4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide (CID 71894008) is 4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide.
What is the SMILES notation for 4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide?
The canonical SMILES for 4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide is O=C(NCCNc1ccccn1)N1CCC(O)CC1.
What is the InChIKey of 4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide?
The InChIKey is JPYZFMOKDJRDFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c18-11-4-9-17(10-5-11)13(19)16-8-7-15-12-3-1-2-6-14-12/h1-3,6,11,18H,4-5,7-10H2,(H,14,15)(H,16,19).
What are the key properties of 4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide?
4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.66, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 71894008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).