5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one

C17H17N3O2 — CID 118001666

IUPAC5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one
SMILESCOc1ccc(Cn2c(=O)ccc3c(NN)cccc32)cc1
InChIInChI=1S/C17H17N3O2/c1-22-13-7-5-12(6-8-13)11-20-16-4-2-3-15(19-18)14(16)9-10-17(20)21/h2-10,19H,11,18H2,1H3
InChIKeyYHQCFABTEGOBHL-UHFFFAOYSA-N
MW295.34 g/mol
LogP2.34
Rot. Bonds4

About 5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one

5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one (PubChem CID 118001666) has the molecular formula C17H17N3O2 and a molecular weight of 295.34 g/mol. Its IUPAC name is 5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one.

Molecular Properties

Compound Name5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one
PubChem CID118001666
Molecular FormulaC17H17N3O2
Molecular Weight295.34 g/mol
Exact Mass295.13
IUPAC Name5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one
SMILESCOc1ccc(Cn2c(=O)ccc3c(NN)cccc32)cc1
InChIInChI=1S/C17H17N3O2/c1-22-13-7-5-12(6-8-13)11-20-16-4-2-3-15(19-18)14(16)9-10-17(20)21/h2-10,19H,11,18H2,1H3
InChIKeyYHQCFABTEGOBHL-UHFFFAOYSA-N
XLogP2.34
TPSA69.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-amino-1-[(4-methoxyphenyl)methyl]quinolin-2-one
CID 118001654
1-[(4-methoxyphenyl)methyl]quinoxalin-2-one
CID 15497841
6-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]pyridin-2-one
CID 4194648
3-methoxy-10-[(4-methylphenyl)methyl]acridin-9-one
CID 12751575
2-ethyl-4-[(4-methoxyphenyl)methyl]pyrazolo[4,3-b]pyridin-5-one
CID 175843982
10-benzyl-3-methoxyacridin-9-one
CID 12751573
1-[(4-methoxyphenyl)methyl]-4-methyl-2-oxoquinoline-3-carbonitrile
CID 166437920
7-bromo-1-[(4-methoxyphenyl)methyl]-1,5-naphthyridin-2-one
CID 67993011
7-hydrazinyl-2-[(4-methoxyphenyl)methyl]-2,5-diazatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaen-3-one
CID 168966701
1,2-dibenzyl-4-[(4-methoxyphenyl)methyl]-1,2,4-triazolidine-3,5-dione
CID 166447403
9-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-carbazol-4-one
CID 10017977
1-[(4-methoxyphenyl)methyl]-3-nitrosoindol-2-ol
CID 2142444

Frequently Asked Questions

What is the IUPAC name of 5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one?
The IUPAC name of 5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one (CID 118001666) is 5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one.
What is the SMILES notation for 5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one?
The canonical SMILES for 5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one is COc1ccc(Cn2c(=O)ccc3c(NN)cccc32)cc1.
What is the InChIKey of 5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one?
The InChIKey is YHQCFABTEGOBHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O2/c1-22-13-7-5-12(6-8-13)11-20-16-4-2-3-15(19-18)14(16)9-10-17(20)21/h2-10,19H,11,18H2,1H3.
What are the key properties of 5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one?
5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one has a molecular weight of 295.34 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-1-[(4-methoxyphenyl)methyl]quinolin-2-one is sourced from PubChem (CID 118001666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).