N-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide

C22H20N6O — CID 90288907

IUPACN-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide
SMILESCC(C)c1cnnc(Nc2ccc3ncc(C(=O)Nc4ccccc4)cc3n2)c1
InChIInChI=1S/C22H20N6O/c1-14(2)15-11-21(28-24-13-15)27-20-9-8-18-19(26-20)10-16(12-23-18)22(29)25-17-6-4-3-5-7-17/h3-14H,1-2H3,(H,25,29)(H,26,27,28)
InChIKeyIZLHSIFGJUGSMY-UHFFFAOYSA-N
MW384.44 g/mol
LogP4.54
Rot. Bonds5

About N-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide

N-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide (PubChem CID 90288907) has the molecular formula C22H20N6O and a molecular weight of 384.44 g/mol. Its IUPAC name is N-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide.

Molecular Properties

Compound NameN-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide
PubChem CID90288907
Molecular FormulaC22H20N6O
Molecular Weight384.44 g/mol
Exact Mass384.17
IUPAC NameN-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide
SMILESCC(C)c1cnnc(Nc2ccc3ncc(C(=O)Nc4ccccc4)cc3n2)c1
InChIInChI=1S/C22H20N6O/c1-14(2)15-11-21(28-24-13-15)27-20-9-8-18-19(26-20)10-16(12-23-18)22(29)25-17-6-4-3-5-7-17/h3-14H,1-2H3,(H,25,29)(H,26,27,28)
InChIKeyIZLHSIFGJUGSMY-UHFFFAOYSA-N
XLogP4.54
TPSA92.69 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 54.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide?
The IUPAC name of N-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide (CID 90288907) is N-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide.
What is the SMILES notation for N-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide?
The canonical SMILES for N-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide is CC(C)c1cnnc(Nc2ccc3ncc(C(=O)Nc4ccccc4)cc3n2)c1.
What is the InChIKey of N-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide?
The InChIKey is IZLHSIFGJUGSMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N6O/c1-14(2)15-11-21(28-24-13-15)27-20-9-8-18-19(26-20)10-16(12-23-18)22(29)25-17-6-4-3-5-7-17/h3-14H,1-2H3,(H,25,29)(H,26,27,28).
What are the key properties of N-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide?
N-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide has a molecular weight of 384.44 g/mol, XLogP of 4.54, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-6-[(5-propan-2-ylpyridazin-3-yl)amino]-1,5-naphthyridine-3-carboxamide is sourced from PubChem (CID 90288907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).