(E)-3-naphthalen-2-ylprop-2-enehydrazide

C13H12N2O — CID 70290410

IUPAC(E)-3-naphthalen-2-ylprop-2-enehydrazide
SMILESNNC(=O)/C=C/c1ccc2ccccc2c1
InChIInChI=1S/C13H12N2O/c14-15-13(16)8-6-10-5-7-11-3-1-2-4-12(11)9-10/h1-9H,14H2,(H,15,16)/b8-6+
InChIKeyYGYCDDJHFRVKNC-SOFGYWHQSA-N
MW212.25 g/mol
LogP1.84
Rot. Bonds2

About (E)-3-naphthalen-2-ylprop-2-enehydrazide

(E)-3-naphthalen-2-ylprop-2-enehydrazide (PubChem CID 70290410) has the molecular formula C13H12N2O and a molecular weight of 212.25 g/mol. Its IUPAC name is (E)-3-naphthalen-2-ylprop-2-enehydrazide.

Molecular Properties

Compound Name(E)-3-naphthalen-2-ylprop-2-enehydrazide
PubChem CID70290410
Molecular FormulaC13H12N2O
Molecular Weight212.25 g/mol
Exact Mass212.09
IUPAC Name(E)-3-naphthalen-2-ylprop-2-enehydrazide
SMILESNNC(=O)/C=C/c1ccc2ccccc2c1
InChIInChI=1S/C13H12N2O/c14-15-13(16)8-6-10-5-7-11-3-1-2-4-12(11)9-10/h1-9H,14H2,(H,15,16)/b8-6+
InChIKeyYGYCDDJHFRVKNC-SOFGYWHQSA-N
XLogP1.84
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-hydroxy-3-naphthalen-2-ylprop-2-enamide
CID 54114861
1,7-dinaphthalen-2-ylhepta-1,6-diene-3,5-dione
CID 86098447
3-[4-(2-phenylethenyl)phenyl]prop-2-enehydrazide
CID 70432340
2-(3-naphthalen-2-ylprop-2-enoylamino)acetic acid
CID 175036011
methyl (2S)-3-hydroxy-2-[[(E)-3-naphthalen-2-ylprop-2-enoyl]amino]propanoate
CID 175887307
(E)-3-(3-bromophenyl)prop-2-enehydrazide
CID 43236571
(E)-3-(4-aminophenyl)prop-2-enehydrazide
CID 79006134
methyl (E)-3-anthracen-2-ylprop-2-enoate
CID 87861616
(E)-3-(4-hydroxy-3-methylphenyl)prop-2-enehydrazide
CID 154724082
2-iminoazaniumylidene-4-naphthalen-2-ylbut-3-enoate
CID 173100173
2-[(E)-2-[4-[(E)-2-naphthalen-2-ylethenyl]phenyl]ethenyl]naphthalene
CID 20801533
(E)-3-(3,4-dimethoxyphenyl)prop-2-enehydrazide
CID 6366846

Frequently Asked Questions

What is the IUPAC name of (E)-3-naphthalen-2-ylprop-2-enehydrazide?
The IUPAC name of (E)-3-naphthalen-2-ylprop-2-enehydrazide (CID 70290410) is (E)-3-naphthalen-2-ylprop-2-enehydrazide.
What is the SMILES notation for (E)-3-naphthalen-2-ylprop-2-enehydrazide?
The canonical SMILES for (E)-3-naphthalen-2-ylprop-2-enehydrazide is NNC(=O)/C=C/c1ccc2ccccc2c1.
What is the InChIKey of (E)-3-naphthalen-2-ylprop-2-enehydrazide?
The InChIKey is YGYCDDJHFRVKNC-SOFGYWHQSA-N. The full InChI is InChI=1S/C13H12N2O/c14-15-13(16)8-6-10-5-7-11-3-1-2-4-12(11)9-10/h1-9H,14H2,(H,15,16)/b8-6+.
What are the key properties of (E)-3-naphthalen-2-ylprop-2-enehydrazide?
(E)-3-naphthalen-2-ylprop-2-enehydrazide has a molecular weight of 212.25 g/mol, XLogP of 1.84, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-naphthalen-2-ylprop-2-enehydrazide is sourced from PubChem (CID 70290410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).