4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide

C25H24N6O2 — CID 70334429

IUPAC4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide
SMILESNc1cc(=O)c2cnc(N3CCN(C(=O)Nc4ccccc4)CC3)cc2n1-c1ccccc1
InChIInChI=1S/C25H24N6O2/c26-23-16-22(32)20-17-27-24(15-21(20)31(23)19-9-5-2-6-10-19)29-11-13-30(14-12-29)25(33)28-18-7-3-1-4-8-18/h1-10,15-17H,11-14,26H2,(H,28,33)
InChIKeyPFKYWUVBKDPZAV-UHFFFAOYSA-N
MW440.51 g/mol
LogP3.32
Rot. Bonds3

About 4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide

4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide (PubChem CID 70334429) has the molecular formula C25H24N6O2 and a molecular weight of 440.51 g/mol. Its IUPAC name is 4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide.

Molecular Properties

Compound Name4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide
PubChem CID70334429
Molecular FormulaC25H24N6O2
Molecular Weight440.51 g/mol
Exact Mass440.20
IUPAC Name4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide
SMILESNc1cc(=O)c2cnc(N3CCN(C(=O)Nc4ccccc4)CC3)cc2n1-c1ccccc1
InChIInChI=1S/C25H24N6O2/c26-23-16-22(32)20-17-27-24(15-21(20)31(23)19-9-5-2-6-10-19)29-11-13-30(14-12-29)25(33)28-18-7-3-1-4-8-18/h1-10,15-17H,11-14,26H2,(H,28,33)
InChIKeyPFKYWUVBKDPZAV-UHFFFAOYSA-N
XLogP3.32
TPSA96.49 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.51
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-anilino-7-(4-benzoylpiperazin-1-yl)-1-phenyl-1,6-naphthyridin-4-one
CID 20790675
4-(5-methyl-2-pyridinyl)-N-phenylpiperazine-1-carboxamide
CID 59676624
N-phenyl-4-pyridin-2-ylpiperazine-1-carboxamide
CID 735809
4-(5-cyano-2-pyridinyl)-N-phenylpiperazine-1-carboxamide
CID 2746537
4-(6-cyclopropylpyridazin-3-yl)-N-phenylpiperazine-1-carboxamide
CID 122279690
N-(4-aminophenyl)-4-pyridin-2-ylpiperazine-1-carboxamide
CID 108897073
N-(2-cyclopropylpyrimidin-5-yl)-4-phenylpiperazine-1-carboxamide
CID 98430279
N-phenyl-4-pyridin-3-yl-1,4-diazepane-1-carboxamide
CID 118068179
N-phenyl-4-(2-piperidin-1-ylpyrimidin-4-yl)piperazine-1-carboxamide
CID 56921957
N-(4-ethylphenyl)-4-(6-phenylpyrimidin-4-yl)piperazine-1-carboxamide
CID 53104085
4-pyridin-2-yl-N-pyridin-3-ylpiperazine-1-carboxamide
CID 18101774
N-[4-(4-methylpiperazin-1-yl)phenyl]-4-phenylpiperazine-1-carboxamide
CID 108989553

Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide?
The IUPAC name of 4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide (CID 70334429) is 4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide.
What is the SMILES notation for 4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide?
The canonical SMILES for 4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide is Nc1cc(=O)c2cnc(N3CCN(C(=O)Nc4ccccc4)CC3)cc2n1-c1ccccc1.
What is the InChIKey of 4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide?
The InChIKey is PFKYWUVBKDPZAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N6O2/c26-23-16-22(32)20-17-27-24(15-21(20)31(23)19-9-5-2-6-10-19)29-11-13-30(14-12-29)25(33)28-18-7-3-1-4-8-18/h1-10,15-17H,11-14,26H2,(H,28,33).
What are the key properties of 4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide?
4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide has a molecular weight of 440.51 g/mol, XLogP of 3.32, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-4-oxo-1-phenyl-1,6-naphthyridin-7-yl)-N-phenylpiperazine-1-carboxamide is sourced from PubChem (CID 70334429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).