2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide

C22H20N2O3 — CID 6234718

IUPAC2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide
SMILESCC(Oc1ccc2ccccc2c1)C(=O)NNC(=O)/C=C/c1ccccc1
InChIInChI=1S/C22H20N2O3/c1-16(27-20-13-12-18-9-5-6-10-19(18)15-20)22(26)24-23-21(25)14-11-17-7-3-2-4-8-17/h2-16H,1H3,(H,23,25)(H,24,26)/b14-11+
InChIKeyBXXRWHMQAYKMKR-SDNWHVSQSA-N
MW360.41 g/mol
LogP3.47
Rot. Bonds5

About 2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide

2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide (PubChem CID 6234718) has the molecular formula C22H20N2O3 and a molecular weight of 360.41 g/mol. Its IUPAC name is 2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide.

Molecular Properties

Compound Name2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide
PubChem CID6234718
Molecular FormulaC22H20N2O3
Molecular Weight360.41 g/mol
Exact Mass360.15
IUPAC Name2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide
SMILESCC(Oc1ccc2ccccc2c1)C(=O)NNC(=O)/C=C/c1ccccc1
InChIInChI=1S/C22H20N2O3/c1-16(27-20-13-12-18-9-5-6-10-19(18)15-20)22(26)24-23-21(25)14-11-17-7-3-2-4-8-17/h2-16H,1H3,(H,23,25)(H,24,26)/b14-11+
InChIKeyBXXRWHMQAYKMKR-SDNWHVSQSA-N
XLogP3.47
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.41
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2R)-2-(3-bromophenoxy)-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide
CID 9370953
(2R)-2-(4-methylphenoxy)-N'-[(2R)-2-naphthalen-2-yloxypropanoyl]propanehydrazide
CID 8757605
(2S)-2-(4-methylphenoxy)-N'-[(2R)-2-naphthalen-2-yloxypropanoyl]propanehydrazide
CID 8757604
(2S)-2-(4-fluorophenoxy)-N'-[(E)-3-(3-methylphenyl)prop-2-enoyl]propanehydrazide
CID 9367296
5-[2-[(2S)-2-naphthalen-2-yloxypropanoyl]hydrazinyl]-5-oxopentanoic acid
CID 8757642
(2R)-2-naphthalen-2-yloxy-N'-propanoylpropanehydrazide
CID 8757548
N'-[(E)-3-(3-chlorophenyl)prop-2-enoyl]-2-(4-fluorophenoxy)propanehydrazide
CID 24638289
(2S)-2-(3-bromophenoxy)-N'-[(E)-3-(3-methylphenyl)prop-2-enoyl]propanehydrazide
CID 9370836
N-[[[(2R)-2-naphthalen-2-yloxypropanoyl]amino]carbamothioyl]acetamide
CID 8757694
(2S)-N'-[(2R)-2-(2-methylphenoxy)propanoyl]-2-naphthalen-2-yloxypropanehydrazide
CID 8757616
(2R)-N-methyl-2-naphthalen-2-yloxypropanamide
CID 42561231
(2S)-2-(4-ethoxyphenoxy)-N'-[(E)-3-(3-fluorophenyl)prop-2-enoyl]propanehydrazide
CID 8960600

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide?
The IUPAC name of 2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide (CID 6234718) is 2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide.
What is the SMILES notation for 2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide?
The canonical SMILES for 2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide is CC(Oc1ccc2ccccc2c1)C(=O)NNC(=O)/C=C/c1ccccc1.
What is the InChIKey of 2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide?
The InChIKey is BXXRWHMQAYKMKR-SDNWHVSQSA-N. The full InChI is InChI=1S/C22H20N2O3/c1-16(27-20-13-12-18-9-5-6-10-19(18)15-20)22(26)24-23-21(25)14-11-17-7-3-2-4-8-17/h2-16H,1H3,(H,23,25)(H,24,26)/b14-11+.
What are the key properties of 2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide?
2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide has a molecular weight of 360.41 g/mol, XLogP of 3.47, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxy-N'-[(E)-3-phenylprop-2-enoyl]propanehydrazide is sourced from PubChem (CID 6234718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).