2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide

C23H21N5O2 — CID 20790439

IUPAC2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide
SMILESCc1nc2c(cc1NCC(N)=O)c(=O)cc(Nc1ccccc1)n2-c1ccccc1
InChIInChI=1S/C23H21N5O2/c1-15-19(25-14-21(24)30)12-18-20(29)13-22(27-16-8-4-2-5-9-16)28(23(18)26-15)17-10-6-3-7-11-17/h2-13,25,27H,14H2,1H3,(H2,24,30)
InChIKeySGBMODZZQNZOFT-UHFFFAOYSA-N
MW399.45 g/mol
LogP3.33
Rot. Bonds6

About 2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide

2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide (PubChem CID 20790439) has the molecular formula C23H21N5O2 and a molecular weight of 399.45 g/mol. Its IUPAC name is 2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide.

Molecular Properties

Compound Name2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide
PubChem CID20790439
Molecular FormulaC23H21N5O2
Molecular Weight399.45 g/mol
Exact Mass399.17
IUPAC Name2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide
SMILESCc1nc2c(cc1NCC(N)=O)c(=O)cc(Nc1ccccc1)n2-c1ccccc1
InChIInChI=1S/C23H21N5O2/c1-15-19(25-14-21(24)30)12-18-20(29)13-22(27-16-8-4-2-5-9-16)28(23(18)26-15)17-10-6-3-7-11-17/h2-13,25,27H,14H2,1H3,(H2,24,30)
InChIKeySGBMODZZQNZOFT-UHFFFAOYSA-N
XLogP3.33
TPSA102.04 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.45
LogP ≤ 53.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide?
The IUPAC name of 2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide (CID 20790439) is 2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide.
What is the SMILES notation for 2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide?
The canonical SMILES for 2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide is Cc1nc2c(cc1NCC(N)=O)c(=O)cc(Nc1ccccc1)n2-c1ccccc1.
What is the InChIKey of 2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide?
The InChIKey is SGBMODZZQNZOFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5O2/c1-15-19(25-14-21(24)30)12-18-20(29)13-22(27-16-8-4-2-5-9-16)28(23(18)26-15)17-10-6-3-7-11-17/h2-13,25,27H,14H2,1H3,(H2,24,30).
What are the key properties of 2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide?
2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide has a molecular weight of 399.45 g/mol, XLogP of 3.33, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridin-3-yl)amino]acetamide is sourced from PubChem (CID 20790439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).