1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide

C14H21N5O2 — CID 71897846

IUPAC1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide
SMILESNC(=O)C1CCN(C(=O)NCCNc2ccccn2)CC1
InChIInChI=1S/C14H21N5O2/c15-13(20)11-4-9-19(10-5-11)14(21)18-8-7-17-12-3-1-2-6-16-12/h1-3,6,11H,4-5,7-10H2,(H2,15,20)(H,16,17)(H,18,21)
InChIKeyCKVXJNGZZUZJSK-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.40
Rot. Bonds5

About 1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide

1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide (PubChem CID 71897846) has the molecular formula C14H21N5O2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide
PubChem CID71897846
Molecular FormulaC14H21N5O2
Molecular Weight291.35 g/mol
Exact Mass291.17
IUPAC Name1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide
SMILESNC(=O)C1CCN(C(=O)NCCNc2ccccn2)CC1
InChIInChI=1S/C14H21N5O2/c15-13(20)11-4-9-19(10-5-11)14(21)18-8-7-17-12-3-1-2-6-16-12/h1-3,6,11H,4-5,7-10H2,(H2,15,20)(H,16,17)(H,18,21)
InChIKeyCKVXJNGZZUZJSK-UHFFFAOYSA-N
XLogP0.40
TPSA100.35 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-oxo-2-(pyridin-2-ylamino)ethyl]piperidine-4-carboxamide
CID 2917692
(3R)-3-(4-methyl-1,2,4-triazol-3-yl)-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1-carboxamide
CID 97076085
1-N-[2-(cyclopropanecarbonylamino)ethyl]piperidine-1,4-dicarboxamide
CID 47127704
1-N-(2-aminoethyl)piperidine-1,4-dicarboxamide
CID 82508838
1-N-(2-naphthalen-1-yloxyethyl)piperidine-1,4-dicarboxamide
CID 56797933
1-N-[2-(6-methyl-3-pyridinyl)ethyl]-4-N-pyridin-2-ylpiperidine-1,4-dicarboxamide
CID 75463453
1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide
CID 110696934
1-N-[2-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-4-N-pyridin-2-ylpiperidine-1,4-dicarboxamide
CID 98845659
1-N-[(2-pyrazol-1-ylphenyl)methyl]piperidine-1,4-dicarboxamide
CID 56820950
methyl 2-[2-[3-(pyridin-2-ylamino)propylcarbamoyl]-1,3,4,5-tetrahydro-2-benzazepin-5-yl]acetate
CID 69178381
1-(pyridin-2-ylmethylcarbamoyl)piperidine-4-carboxylic acid
CID 43318535
1-[2-(pyridin-2-ylamino)-1,3-thiazole-4-carbonyl]piperidine-4-carboxamide
CID 90509743

Frequently Asked Questions

What is the IUPAC name of 1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide?
The IUPAC name of 1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide (CID 71897846) is 1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide is NC(=O)C1CCN(C(=O)NCCNc2ccccn2)CC1.
What is the InChIKey of 1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide?
The InChIKey is CKVXJNGZZUZJSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2/c15-13(20)11-4-9-19(10-5-11)14(21)18-8-7-17-12-3-1-2-6-16-12/h1-3,6,11H,4-5,7-10H2,(H2,15,20)(H,16,17)(H,18,21).
What are the key properties of 1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide?
1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide has a molecular weight of 291.35 g/mol, XLogP of 0.40, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-[2-(pyridin-2-ylamino)ethyl]piperidine-1,4-dicarboxamide is sourced from PubChem (CID 71897846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).