3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one

C11H10N2O — CID 70291895

IUPAC3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one
SMILESC/C=C\c1cnc2c(=O)[nH]ccc2c1
InChIInChI=1S/C11H10N2O/c1-2-3-8-6-9-4-5-12-11(14)10(9)13-7-8/h2-7H,1H3,(H,12,14)/b3-2-
InChIKeyPIGCYCLSFFLBED-IHWYPQMZSA-N
MW186.21 g/mol
LogP1.96
Rot. Bonds1

About 3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one

3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one (PubChem CID 70291895) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one.

Molecular Properties

Compound Name3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one
PubChem CID70291895
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one
SMILESC/C=C\c1cnc2c(=O)[nH]ccc2c1
InChIInChI=1S/C11H10N2O/c1-2-3-8-6-9-4-5-12-11(14)10(9)13-7-8/h2-7H,1H3,(H,12,14)/b3-2-
InChIKeyPIGCYCLSFFLBED-IHWYPQMZSA-N
XLogP1.96
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 ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoro-7H-1,7-naphthyridin-8-one
CID 130866766
3-cyclopropyl-7H-1,7-naphthyridin-8-one
CID 171099032
2-ethyl-6H-pyrido[3,4-b]pyrazin-5-one
CID 149402131
6-chloro-3-prop-1-enylquinoline
CID 174515069
5-[(E)-2-phenylethenyl]-1H-pyrrolo[2,3-b]pyridine
CID 89409031
3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-en-1-ol
CID 169453432
2-methoxy-6H-pyrido[3,4-b]pyrazin-5-one
CID 122435153
N-[3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-enyl]acetamide
CID 169465580
6-prop-1-enyl-1H-imidazo[4,5-b]pyridine
CID 123869797
ethyl (E)-3-(1H-pyrrolo[2,3-b]pyridin-5-yl)prop-2-enoate
CID 175662950
(E)-N-methyl-5-(1H-pyrrolo[2,3-b]pyridin-5-yl)pent-4-en-2-amine
CID 22714596
2-(methylamino)-7H-1,7-naphthyridin-8-one
CID 142879401

Frequently Asked Questions

What is the IUPAC name of 3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one?
The IUPAC name of 3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one (CID 70291895) is 3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one.
What is the SMILES notation for 3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one?
The canonical SMILES for 3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one is C/C=C\c1cnc2c(=O)[nH]ccc2c1.
What is the InChIKey of 3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one?
The InChIKey is PIGCYCLSFFLBED-IHWYPQMZSA-N. The full InChI is InChI=1S/C11H10N2O/c1-2-3-8-6-9-4-5-12-11(14)10(9)13-7-8/h2-7H,1H3,(H,12,14)/b3-2-.
What are the key properties of 3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one?
3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one has a molecular weight of 186.21 g/mol, XLogP of 1.96, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(Z)-prop-1-enyl]-7H-1,7-naphthyridin-8-one is sourced from PubChem (CID 70291895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).