7-methyl-2-propyl-1H-1,8-naphthyridin-4-one

C12H14N2O — CID 13155595

IUPAC7-methyl-2-propyl-1H-1,8-naphthyridin-4-one
SMILESCCCc1cc(=O)c2ccc(C)nc2[nH]1
InChIInChI=1S/C12H14N2O/c1-3-4-9-7-11(15)10-6-5-8(2)13-12(10)14-9/h5-7H,3-4H2,1-2H3,(H,13,14,15)
InChIKeyJAFFZYFREVCDTP-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.18
Rot. Bonds2

About 7-methyl-2-propyl-1H-1,8-naphthyridin-4-one

7-methyl-2-propyl-1H-1,8-naphthyridin-4-one (PubChem CID 13155595) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 7-methyl-2-propyl-1H-1,8-naphthyridin-4-one.

Molecular Properties

Compound Name7-methyl-2-propyl-1H-1,8-naphthyridin-4-one
PubChem CID13155595
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name7-methyl-2-propyl-1H-1,8-naphthyridin-4-one
SMILESCCCc1cc(=O)c2ccc(C)nc2[nH]1
InChIInChI=1S/C12H14N2O/c1-3-4-9-7-11(15)10-6-5-8(2)13-12(10)14-9/h5-7H,3-4H2,1-2H3,(H,13,14,15)
InChIKeyJAFFZYFREVCDTP-UHFFFAOYSA-N
XLogP2.18
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-2-propyl-1H-1,8-naphthyridin-4-one?
The IUPAC name of 7-methyl-2-propyl-1H-1,8-naphthyridin-4-one (CID 13155595) is 7-methyl-2-propyl-1H-1,8-naphthyridin-4-one.
What is the SMILES notation for 7-methyl-2-propyl-1H-1,8-naphthyridin-4-one?
The canonical SMILES for 7-methyl-2-propyl-1H-1,8-naphthyridin-4-one is CCCc1cc(=O)c2ccc(C)nc2[nH]1.
What is the InChIKey of 7-methyl-2-propyl-1H-1,8-naphthyridin-4-one?
The InChIKey is JAFFZYFREVCDTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-3-4-9-7-11(15)10-6-5-8(2)13-12(10)14-9/h5-7H,3-4H2,1-2H3,(H,13,14,15).
What are the key properties of 7-methyl-2-propyl-1H-1,8-naphthyridin-4-one?
7-methyl-2-propyl-1H-1,8-naphthyridin-4-one has a molecular weight of 202.26 g/mol, XLogP of 2.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-2-propyl-1H-1,8-naphthyridin-4-one is sourced from PubChem (CID 13155595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).