[2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium

C24H24N3O+ — CID 58524517

IUPAC[2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium
SMILESCC(C)C([NH3+])c1ccc(-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)cc1
InChIInChI=1S/C24H23N3O/c1-15(2)22(25)17-8-10-18(11-9-17)23-19(16-6-4-3-5-7-16)14-20-21(27-23)12-13-26-24(20)28/h3-15,22H,25H2,1-2H3,(H,26,28)/p+1
InChIKeyOKPDDIQGQFPSAS-UHFFFAOYSA-O
MW370.48 g/mol
LogP4.20
Rot. Bonds4

About [2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium

[2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium (PubChem CID 58524517) has the molecular formula C24H24N3O+ and a molecular weight of 370.48 g/mol. Its IUPAC name is [2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium.

Molecular Properties

Compound Name[2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium
PubChem CID58524517
Molecular FormulaC24H24N3O+
Molecular Weight370.48 g/mol
Exact Mass370.19
IUPAC Name[2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium
SMILESCC(C)C([NH3+])c1ccc(-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)cc1
InChIInChI=1S/C24H23N3O/c1-15(2)22(25)17-8-10-18(11-9-17)23-19(16-6-4-3-5-7-16)14-20-21(27-23)12-13-26-24(20)28/h3-15,22H,25H2,1-2H3,(H,26,28)/p+1
InChIKeyOKPDDIQGQFPSAS-UHFFFAOYSA-O
XLogP4.20
TPSA73.39 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.48
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(1-aminopropyl)phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one
CID 46865724
2-[4-[(4-ethenylsulfanylpiperazin-1-yl)methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one
CID 177349423
3-phenyl-2-[4-[[3-(triazol-1-yl)propylamino]methyl]phenyl]-6H-1,6-naphthyridin-5-one
CID 11719060
3-phenyl-2-[4-[(4-prop-2-enoylpiperazin-1-yl)methyl]phenyl]-6H-1,6-naphthyridin-5-one
CID 177349433
2-[4-(1,3,4,4a,5,6,7,8,9,9a-decahydrocyclohepta[c]pyridin-2-ylmethyl)phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one
CID 143309013
2-[4-[[(6-methoxy-1H-benzimidazol-2-yl)methylamino]methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one
CID 91347562
2-[4-[[2-[(5-nitro-2-pyridinyl)amino]ethylamino]methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one
CID 11554977
2,2,2-trifluoro-N-[1-[[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]methyl]-2H-pyridin-3-yl]acetamide
CID 87251881
(1R)-1-[4-(5-chloro-3-phenyl-1,6-naphthyridin-2-yl)phenyl]ethanamine
CID 58524476
2-[4-(1-aminoethyl)phenyl]-3-cyclohexa-2,4-dien-1-yl-6H-1,6-naphthyridin-5-one
CID 163634850
1-[(3R)-1-[[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]methyl]pyrrolidin-3-yl]-3-phenylurea
CID 59846146
3-phenyl-2-[4-[[2-(6-phenyl-3,6-diazabicyclo[3.2.0]heptan-3-yl)ethylamino]methyl]phenyl]-6H-1,6-naphthyridin-5-one
CID 11526572

Frequently Asked Questions

What is the IUPAC name of [2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium?
The IUPAC name of [2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium (CID 58524517) is [2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium.
What is the SMILES notation for [2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium?
The canonical SMILES for [2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium is CC(C)C([NH3+])c1ccc(-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)cc1.
What is the InChIKey of [2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium?
The InChIKey is OKPDDIQGQFPSAS-UHFFFAOYSA-O. The full InChI is InChI=1S/C24H23N3O/c1-15(2)22(25)17-8-10-18(11-9-17)23-19(16-6-4-3-5-7-16)14-20-21(27-23)12-13-26-24(20)28/h3-15,22H,25H2,1-2H3,(H,26,28)/p+1.
What are the key properties of [2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium?
[2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium has a molecular weight of 370.48 g/mol, XLogP of 4.20, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-1-[4-(5-oxo-3-phenyl-6H-1,6-naphthyridin-2-yl)phenyl]propyl]azanium is sourced from PubChem (CID 58524517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).