ethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one

C10H16N2O — CID 143136259

IUPACethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one
SMILESCC.O=c1ccc2c([nH]1)CNCC2
InChIInChI=1S/C8H10N2O.C2H6/c11-8-2-1-6-3-4-9-5-7(6)10-8;1-2/h1-2,9H,3-5H2,(H,10,11);1-2H3
InChIKeyQJGGKZFFXBGZCP-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.05
Rot. Bonds

About ethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one

ethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one (PubChem CID 143136259) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is ethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one.

Molecular Properties

Compound Nameethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one
PubChem CID143136259
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Nameethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one
SMILESCC.O=c1ccc2c([nH]1)CNCC2
InChIInChI=1S/C8H10N2O.C2H6/c11-8-2-1-6-3-4-9-5-7(6)10-8;1-2/h1-2,9H,3-5H2,(H,10,11);1-2H3
InChIKeyQJGGKZFFXBGZCP-UHFFFAOYSA-N
XLogP1.05
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze ethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-amino-5,6,7,8-tetrahydroquinolin-2(1H)-one
CID 5148061
5-(Butylamino)-5,6,7,8-tetrahydro-2(1H)-quinolinone
CID 10656568
1,2,5,6,7,8-Hexahydro-1,6-naphthyridin-2-one hydrochloride
CID 66523912
6-Amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2(1H)-one
CID 84618285
6-(propan-2-ylamino)-5,6,7,8-tetrahydro-1H-quinolin-2-one
CID 118744521
1-[2-(Dimethylamino)ethyl]-6-(propan-2-ylamino)-5,6,7,8-tetrahydroquinolin-2-one
CID 118745778
8,8-Dimethyl-1,2,5,6,7,8-hexahydro-1,6-naphthyridin-2-one hydrochloride
CID 155858877
5,6,7,8-Tetrahydro-1,6-naphthyridin-2(1H)-one
CID 21071189
5H,6H,7H-pyrrolo[3,4-b]pyridin-2-ol
CID 56956224
8,8-dimethyl-5,6,7,8-tetrahydro-1,6-naphthyridin-2(1H)-one
CID 68437429
3-(difluoromethyl)-5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one
CID 176653804
3-fluoro-5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one
CID 176653805

Frequently Asked Questions

What is the IUPAC name of ethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one?
The IUPAC name of ethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one (CID 143136259) is ethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one.
What is the SMILES notation for ethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one?
The canonical SMILES for ethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one is CC.O=c1ccc2c([nH]1)CNCC2.
What is the InChIKey of ethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one?
The InChIKey is QJGGKZFFXBGZCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O.C2H6/c11-8-2-1-6-3-4-9-5-7(6)10-8;1-2/h1-2,9H,3-5H2,(H,10,11);1-2H3.
What are the key properties of ethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one?
ethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one has a molecular weight of 180.25 g/mol, XLogP of 1.05, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5,6,7,8-tetrahydro-1H-1,7-naphthyridin-2-one is sourced from PubChem (CID 143136259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).