2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one

C12H14N2O — CID 13155599

IUPAC2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one
SMILESCc1cc(C)c2c(=O)c(C)c(C)[nH]c2n1
InChIInChI=1S/C12H14N2O/c1-6-5-7(2)13-12-10(6)11(15)8(3)9(4)14-12/h5H,1-4H3,(H,13,14,15)
InChIKeyZAAYEDAPUBUJOY-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.16
Rot. Bonds

About 2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one

2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one (PubChem CID 13155599) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one.

Molecular Properties

Compound Name2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one
PubChem CID13155599
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one
SMILESCc1cc(C)c2c(=O)c(C)c(C)[nH]c2n1
InChIInChI=1S/C12H14N2O/c1-6-5-7(2)13-12-10(6)11(15)8(3)9(4)14-12/h5H,1-4H3,(H,13,14,15)
InChIKeyZAAYEDAPUBUJOY-UHFFFAOYSA-N
XLogP2.16
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(chloromethyl)-3,5,7-trimethyl-1H-1,8-naphthyridin-4-one
CID 54439496
5,7-dimethyl-1H-pyrido[2,3-d]pyrimidine-2,4-dione
CID 5410048
7-ethyl-2,4-dimethyl-10H-benzo[b][1,8]naphthyridin-5-one
CID 5396607
2,5,7-trimethyl-3H-pyrido[2,3-d]pyrimidin-4-one
CID 135767387
3,5-dimethyl-6,8-diazatricyclo[7.5.0.02,7]tetradeca-1(9),2(7),3,5-tetraene
CID 22896644
5,7-dimethyl-2-naphthalen-2-yl-1H-1,8-naphthyridin-4-one
CID 5468909
5-bromo-6-fluoro-2,3,8-trimethyl-1H-quinolin-4-one
CID 107593541
1-(2-chloroacetyl)-4,6-dimethyl-2H-pyrazolo[3,4-b]pyridin-3-one
CID 4962266
2-(4-hydroxy-3,5-dimethylphenyl)-5,7-dimethyl-3H-pyrido[2,3-d]pyrimidin-4-one
CID 135894083
5,7-dimethyl-3H-pyrido[2,3-d]pyrimidin-4-one
CID 135408240
2,3,5,7-tetramethylpyrido[2,3-d]pyrimidin-4-one
CID 12910050
(4,6-dimethyl-1H-pyrazolo[5,4-b]pyridin-3-yl)thiourea
CID 1477620

Frequently Asked Questions

What is the IUPAC name of 2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one?
The IUPAC name of 2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one (CID 13155599) is 2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one.
What is the SMILES notation for 2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one?
The canonical SMILES for 2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one is Cc1cc(C)c2c(=O)c(C)c(C)[nH]c2n1.
What is the InChIKey of 2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one?
The InChIKey is ZAAYEDAPUBUJOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-6-5-7(2)13-12-10(6)11(15)8(3)9(4)14-12/h5H,1-4H3,(H,13,14,15).
What are the key properties of 2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one?
2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one has a molecular weight of 202.26 g/mol, XLogP of 2.16, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,7-tetramethyl-1H-1,8-naphthyridin-4-one is sourced from PubChem (CID 13155599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).