1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane

C14H24N2O — CID 162737758

IUPAC1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane
SMILESCC.CC.Cc1ccc2c(n1)N(C)C(=O)CC2
InChIInChI=1S/C10H12N2O.2C2H6/c1-7-3-4-8-5-6-9(13)12(2)10(8)11-7;2*1-2/h3-4H,5-6H2,1-2H3;2*1-2H3
InChIKeyPUBZRJQYTHDUCH-UHFFFAOYSA-N
MW236.36 g/mol
LogP3.35
Rot. Bonds

About 1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane

1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane (PubChem CID 162737758) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane.

Molecular Properties

Compound Name1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane
PubChem CID162737758
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane
SMILESCC.CC.Cc1ccc2c(n1)N(C)C(=O)CC2
InChIInChI=1S/C10H12N2O.2C2H6/c1-7-3-4-8-5-6-9(13)12(2)10(8)11-7;2*1-2/h3-4H,5-6H2,1-2H3;2*1-2H3
InChIKeyPUBZRJQYTHDUCH-UHFFFAOYSA-N
XLogP3.35
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;N,1,7-trimethyl-3,4-dihydro-1,8-naphthyridin-2-imine
CID 91335327
1,6-dimethyl-2,3-dihydropyrrolo[2,3-b]pyridine
CID 21341307
1,2,7-trimethyl-4H-pyrido[2,3-d]pyrimidine
CID 18740830
1,7-dimethyl-3,4-dihydroquinolin-2-one
CID 54207242
9-methyl-2-[2-(oxetan-3-yl)ethynyl]-6,7-dihydro-5H-pyrido[2,3-b]azepin-8-one
CID 166780458
1,5-dimethyl-3H-pyrrolo[3,2-b]pyridin-2-one
CID 58398941
1,6-dimethyl-3,4-dihydroquinolin-2-one
CID 20546933
7-chloro-1-propan-2-yl-3,4-dihydro-1,8-naphthyridin-2-one
CID 89022817
1-methyl-2-oxo-3,4-dihydroquinoline-7-carbaldehyde
CID 83483627
1-methyl-3,4,5,6-tetrahydrobenzo[h]quinolin-2-one
CID 24974677
CID 144763969
CID 144763969
2,4-dichloro-8-methyl-5,6-dihydropyrido[2,3-d]pyrimidin-7-one
CID 117272981

Frequently Asked Questions

What is the IUPAC name of 1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane?
The IUPAC name of 1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane (CID 162737758) is 1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane.
What is the SMILES notation for 1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane?
The canonical SMILES for 1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane is CC.CC.Cc1ccc2c(n1)N(C)C(=O)CC2.
What is the InChIKey of 1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane?
The InChIKey is PUBZRJQYTHDUCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O.2C2H6/c1-7-3-4-8-5-6-9(13)12(2)10(8)11-7;2*1-2/h3-4H,5-6H2,1-2H3;2*1-2H3.
What are the key properties of 1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane?
1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane has a molecular weight of 236.36 g/mol, XLogP of 3.35, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane is sourced from PubChem (CID 162737758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).