7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide

C25H22N4O2 — CID 10201627

IUPAC7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide
SMILESCc1cc(C(=O)NC2CC2)nc2c1c(=O)cc(Nc1ccccc1)n2-c1ccccc1
InChIInChI=1S/C25H22N4O2/c1-16-14-20(25(31)27-18-12-13-18)28-24-23(16)21(30)15-22(26-17-8-4-2-5-9-17)29(24)19-10-6-3-7-11-19/h2-11,14-15,18,26H,12-13H2,1H3,(H,27,31)
InChIKeyBXCNPCZNBZLMRI-UHFFFAOYSA-N
MW410.48 g/mol
LogP4.33
Rot. Bonds5

About 7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide

7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide (PubChem CID 10201627) has the molecular formula C25H22N4O2 and a molecular weight of 410.48 g/mol. Its IUPAC name is 7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide.

Molecular Properties

Compound Name7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide
PubChem CID10201627
Molecular FormulaC25H22N4O2
Molecular Weight410.48 g/mol
Exact Mass410.17
IUPAC Name7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide
SMILESCc1cc(C(=O)NC2CC2)nc2c1c(=O)cc(Nc1ccccc1)n2-c1ccccc1
InChIInChI=1S/C25H22N4O2/c1-16-14-20(25(31)27-18-12-13-18)28-24-23(16)21(30)15-22(26-17-8-4-2-5-9-17)29(24)19-10-6-3-7-11-19/h2-11,14-15,18,26H,12-13H2,1H3,(H,27,31)
InChIKeyBXCNPCZNBZLMRI-UHFFFAOYSA-N
XLogP4.33
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.48
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide?
The IUPAC name of 7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide (CID 10201627) is 7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide.
What is the SMILES notation for 7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide?
The canonical SMILES for 7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide is Cc1cc(C(=O)NC2CC2)nc2c1c(=O)cc(Nc1ccccc1)n2-c1ccccc1.
What is the InChIKey of 7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide?
The InChIKey is BXCNPCZNBZLMRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22N4O2/c1-16-14-20(25(31)27-18-12-13-18)28-24-23(16)21(30)15-22(26-17-8-4-2-5-9-17)29(24)19-10-6-3-7-11-19/h2-11,14-15,18,26H,12-13H2,1H3,(H,27,31).
What are the key properties of 7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide?
7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide has a molecular weight of 410.48 g/mol, XLogP of 4.33, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-anilino-N-cyclopropyl-4-methyl-5-oxo-8-phenyl-1,8-naphthyridine-2-carboxamide is sourced from PubChem (CID 10201627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).