N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide

C16H18N4O — CID 735809

IUPACN-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C16H18N4O/c21-16(18-14-6-2-1-3-7-14)20-12-10-19(11-13-20)15-8-4-5-9-17-15/h1-9H,10-13H2,(H,18,21)
InChIKeyCCEBZZZONAXMFM-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.44
Rot. Bonds2

About N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide

N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide (PubChem CID 735809) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide
PubChem CID735809
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC NameN-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide
SMILESO=C(Nc1ccccc1)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C16H18N4O/c21-16(18-14-6-2-1-3-7-14)20-12-10-19(11-13-20)15-8-4-5-9-17-15/h1-9H,10-13H2,(H,18,21)
InChIKeyCCEBZZZONAXMFM-UHFFFAOYSA-N
XLogP2.44
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide
CID 18101774
dimethyl 5-[(4-pyridin-2-ylpiperazine-1-carbonyl)amino]benzene-1,3-dicarboxylate
CID 3866296
4-(5-methyl-2-pyridinyl)-N-phenylpiperazine-1-carboxamide
CID 59676624
N-phenyl-1-(4-pyridin-2-ylpiperazine-1-carbonyl)cyclopropane-1-carboxamide
CID 108978927
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
N-[3-(ethoxymethyl)phenyl]-4-pyridin-2-ylpiperazine-1-carboxamide
CID 122131762
N-[4-(4-pyridin-2-ylpiperazine-1-carbonyl)phenyl]acetamide
CID 18166383
4-pyridin-2-yl-N-(1,2,5-thiadiazol-3-yl)piperazine-1-carboxamide
CID 4236681
N-phenyl-4-(2-piperidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide
CID 56921957

Frequently Asked Questions

What is the IUPAC name of N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide?
The IUPAC name of N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide (CID 735809) is N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide.
What is the SMILES notation for N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide?
The canonical SMILES for N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide is O=C(Nc1ccccc1)N1CCN(c2ccccn2)CC1.
What is the InChIKey of N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide?
The InChIKey is CCEBZZZONAXMFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c21-16(18-14-6-2-1-3-7-14)20-12-10-19(11-13-20)15-8-4-5-9-17-15/h1-9H,10-13H2,(H,18,21).
What are the key properties of N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide?
N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide has a molecular weight of 282.35 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide is sourced from PubChem (CID 735809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).