3-cyclopropyl-7H-1,7-naphthyridin-8-one

C11H10N2O — CID 171099032

IUPAC3-cyclopropyl-7H-1,7-naphthyridin-8-one
SMILESO=c1[nH]ccc2cc(C3CC3)cnc12
InChIInChI=1S/C11H10N2O/c14-11-10-8(3-4-12-11)5-9(6-13-10)7-1-2-7/h3-7H,1-2H2,(H,12,14)
InChIKeyNPCNFUPQVSXREH-UHFFFAOYSA-N
MW186.21 g/mol
LogP1.80
Rot. Bonds1

About 3-cyclopropyl-7H-1,7-naphthyridin-8-one

3-cyclopropyl-7H-1,7-naphthyridin-8-one (PubChem CID 171099032) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 3-cyclopropyl-7H-1,7-naphthyridin-8-one.

Molecular Properties

Compound Name3-cyclopropyl-7H-1,7-naphthyridin-8-one
PubChem CID171099032
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name3-cyclopropyl-7H-1,7-naphthyridin-8-one
SMILESO=c1[nH]ccc2cc(C3CC3)cnc12
InChIInChI=1S/C11H10N2O/c14-11-10-8(3-4-12-11)5-9(6-13-10)7-1-2-7/h3-7H,1-2H2,(H,12,14)
InChIKeyNPCNFUPQVSXREH-UHFFFAOYSA-N
XLogP1.80
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoro-7H-1,7-naphthyridin-8-one
CID 130866766
6-cyclopropyl-2H-isoquinolin-1-one
CID 90054240
3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one
CID 70291895
methyl 3-cyclopropyl-8-methylquinoline-6-carboxylate
CID 165133811
5-(4-methylcyclohexyl)-1H-indole
CID 69051193
2-ethyl-6H-pyrido[3,4-b]pyrazin-5-one
CID 149402131
2-methoxy-6H-pyrido[3,4-b]pyrazin-5-one
CID 122435153
5-cyclopropyl-3-methyl-1H-pyridin-2-one
CID 83131325
2,3-dibromo-5-cyclopropylpyridine
CID 130053485
1H-pyrrolo[3,2-h]quinoline-7-carboxylic acid
CID 96613315
6-(chloromethyl)-3-cyclopropylquinoline
CID 134178572
7-cyclopropyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one
CID 91618987

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-7H-1,7-naphthyridin-8-one?
The IUPAC name of 3-cyclopropyl-7H-1,7-naphthyridin-8-one (CID 171099032) is 3-cyclopropyl-7H-1,7-naphthyridin-8-one.
What is the SMILES notation for 3-cyclopropyl-7H-1,7-naphthyridin-8-one?
The canonical SMILES for 3-cyclopropyl-7H-1,7-naphthyridin-8-one is O=c1[nH]ccc2cc(C3CC3)cnc12.
What is the InChIKey of 3-cyclopropyl-7H-1,7-naphthyridin-8-one?
The InChIKey is NPCNFUPQVSXREH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c14-11-10-8(3-4-12-11)5-9(6-13-10)7-1-2-7/h3-7H,1-2H2,(H,12,14).
What are the key properties of 3-cyclopropyl-7H-1,7-naphthyridin-8-one?
3-cyclopropyl-7H-1,7-naphthyridin-8-one has a molecular weight of 186.21 g/mol, XLogP of 1.80, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-7H-1,7-naphthyridin-8-one is sourced from PubChem (CID 171099032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).