8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide

C18H17FN2O2 — CID 70895520

IUPAC8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide
SMILESCOc1ccc(C2=CCCc3ccc(C(=O)NN)cc32)c(F)c1
InChIInChI=1S/C18H17FN2O2/c1-23-13-7-8-15(17(19)10-13)14-4-2-3-11-5-6-12(9-16(11)14)18(22)21-20/h4-10H,2-3,20H2,1H3,(H,21,22)
InChIKeySVDVNOKIARBHMJ-UHFFFAOYSA-N
MW312.34 g/mol
LogP2.82
Rot. Bonds3

About 8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide

8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide (PubChem CID 70895520) has the molecular formula C18H17FN2O2 and a molecular weight of 312.34 g/mol. Its IUPAC name is 8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide.

Molecular Properties

Compound Name8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide
PubChem CID70895520
Molecular FormulaC18H17FN2O2
Molecular Weight312.34 g/mol
Exact Mass312.13
IUPAC Name8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide
SMILESCOc1ccc(C2=CCCc3ccc(C(=O)NN)cc32)c(F)c1
InChIInChI=1S/C18H17FN2O2/c1-23-13-7-8-15(17(19)10-13)14-4-2-3-11-5-6-12(9-16(11)14)18(22)21-20/h4-10H,2-3,20H2,1H3,(H,21,22)
InChIKeySVDVNOKIARBHMJ-UHFFFAOYSA-N
XLogP2.82
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.34
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

8-(2-methoxycyclohexa-1,3-dien-1-yl)-5,6-dihydronaphthalene-2-carbohydrazide
CID 70895529
methyl 8-(3,4-difluorophenyl)-5,6-dihydronaphthalene-2-carboxylate
CID 58407203
N-[N'-(2-methoxyethyl)carbamimidoyl]-8-(2-methoxyphenyl)-5,6-dihydronaphthalene-2-carboxamide
CID 25190380
methyl 8-[2-(nitrosomethyl)phenyl]-5,6-dihydronaphthalene-2-carboxylate
CID 89076920
methyl 8-(4-methyl-3-pyridinyl)-5,6-dihydronaphthalene-2-carboxylate
CID 58407462
8-(2,4-dimethylphenyl)-5,6-dihydronaphthalene-2-carboxylic acid
CID 58407165
methyl 8-pyrazin-2-yl-5,6-dihydronaphthalene-2-carboxylate
CID 58406598
2-(7-methoxy-3,4-dihydronaphthalen-1-yl)-N-[2-(7-methoxy-3,4-dihydronaphthalen-1-yl)ethyl]ethanamine
CID 123816492
8-(5-chloro-2-methylphenyl)-5,6-dihydronaphthalene-2-carboxylic acid
CID 58406897
methyl 8-(4-nitrophenyl)-5,6-dihydronaphthalene-2-carboxylate
CID 58407020
7-methoxy-3,4-dihydronaphthalene-1-carbonitrile
CID 11521201
1-[4-(2-fluoro-4-methoxyphenyl)phenyl]propan-2-one
CID 82541027

Frequently Asked Questions

What is the IUPAC name of 8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide?
The IUPAC name of 8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide (CID 70895520) is 8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide.
What is the SMILES notation for 8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide?
The canonical SMILES for 8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide is COc1ccc(C2=CCCc3ccc(C(=O)NN)cc32)c(F)c1.
What is the InChIKey of 8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide?
The InChIKey is SVDVNOKIARBHMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2O2/c1-23-13-7-8-15(17(19)10-13)14-4-2-3-11-5-6-12(9-16(11)14)18(22)21-20/h4-10H,2-3,20H2,1H3,(H,21,22).
What are the key properties of 8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide?
8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide has a molecular weight of 312.34 g/mol, XLogP of 2.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-fluoro-4-methoxyphenyl)-5,6-dihydronaphthalene-2-carbohydrazide is sourced from PubChem (CID 70895520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).