4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide

C15H17N5O — CID 18101774

IUPAC4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide
SMILESO=C(Nc1cccnc1)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C15H17N5O/c21-15(18-13-4-3-6-16-12-13)20-10-8-19(9-11-20)14-5-1-2-7-17-14/h1-7,12H,8-11H2,(H,18,21)
InChIKeyIYPRLYAXVSAUGJ-UHFFFAOYSA-N
MW283.33 g/mol
LogP1.83
Rot. Bonds2

About 4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide

4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide (PubChem CID 18101774) has the molecular formula C15H17N5O and a molecular weight of 283.33 g/mol. Its IUPAC name is 4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide
PubChem CID18101774
Molecular FormulaC15H17N5O
Molecular Weight283.33 g/mol
Exact Mass283.14
IUPAC Name4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide
SMILESO=C(Nc1cccnc1)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C15H17N5O/c21-15(18-13-4-3-6-16-12-13)20-10-8-19(9-11-20)14-5-1-2-7-17-14/h1-7,12H,8-11H2,(H,18,21)
InChIKeyIYPRLYAXVSAUGJ-UHFFFAOYSA-N
XLogP1.83
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide
CID 735809
N-(4-aminophenyl)-4-pyridin-2-ylpiperazine-1-carboxamide
CID 108897073
4-pyridin-2-yl-N-[4-[[4-[(4-pyridin-2-ylpiperazine-1-carbonyl)amino]phenyl]methyl]phenyl]piperazine-1-carboxamide
CID 4118042
4-formyl-N-pyridin-3-ylpiperazine-1-carboxamide
CID 110706402
4-methyl-N-pyridin-3-ylpiperazine-1-carboxamide
CID 3370606
dimethyl 5-[(4-pyridin-2-ylpiperazine-1-carbonyl)amino]benzene-1,3-dicarboxylate
CID 3866296
4-pyridin-2-yl-N-(1,2,5-thiadiazol-3-yl)piperazine-1-carboxamide
CID 4236681
N-(2,1,3-benzothiadiazol-5-yl)-4-pyridin-2-ylpiperazine-1-carboxamide
CID 778358
4-pyridin-2-yl-N-(1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 47148349
4-pyridin-2-yl-N-quinoxalino[3,2-f][1,10]phenanthrolin-11-ylpiperazine-1-carboxamide
CID 126341158
4-(bromomethylidene)-N-pyridin-3-ylpiperidine-1-carboxamide
CID 66883942
N-phenyl-4-pyridin-3-yl-1,4-diazepane-1-carboxamide
CID 118068179

Frequently Asked Questions

What is the IUPAC name of 4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide?
The IUPAC name of 4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide (CID 18101774) is 4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide.
What is the SMILES notation for 4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide?
The canonical SMILES for 4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide is O=C(Nc1cccnc1)N1CCN(c2ccccn2)CC1.
What is the InChIKey of 4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide?
The InChIKey is IYPRLYAXVSAUGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O/c21-15(18-13-4-3-6-16-12-13)20-10-8-19(9-11-20)14-5-1-2-7-17-14/h1-7,12H,8-11H2,(H,18,21).
What are the key properties of 4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide?
4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide has a molecular weight of 283.33 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide is sourced from PubChem (CID 18101774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).