(2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide

C22H19N3O4 — CID 8008591

IUPAC(2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide
SMILESC[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)COc1ccccc1C#N
InChIInChI=1S/C22H19N3O4/c1-15(29-19-11-10-16-6-2-3-7-17(16)12-19)22(27)25-24-21(26)14-28-20-9-5-4-8-18(20)13-23/h2-12,15H,14H2,1H3,(H,24,26)(H,25,27)/t15-/m1/s1
InChIKeyBXGCZKSYYYZVBL-OAHLLOKOSA-N
MW389.41 g/mol
LogP2.71
Rot. Bonds6

About (2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide

(2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide (PubChem CID 8008591) has the molecular formula C22H19N3O4 and a molecular weight of 389.41 g/mol. Its IUPAC name is (2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide.

Molecular Properties

Compound Name(2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide
PubChem CID8008591
Molecular FormulaC22H19N3O4
Molecular Weight389.41 g/mol
Exact Mass389.14
IUPAC Name(2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide
SMILESC[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)COc1ccccc1C#N
InChIInChI=1S/C22H19N3O4/c1-15(29-19-11-10-16-6-2-3-7-17(16)12-19)22(27)25-24-21(26)14-28-20-9-5-4-8-18(20)13-23/h2-12,15H,14H2,1H3,(H,24,26)(H,25,27)/t15-/m1/s1
InChIKeyBXGCZKSYYYZVBL-OAHLLOKOSA-N
XLogP2.71
TPSA100.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.41
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

(2R)-N'-[2-(2-fluorophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide
CID 7927377
(2S)-N'-[2-(4-methoxyphenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide
CID 8757594
(2S)-2-(4-fluorophenoxy)-N'-(2-naphthalen-2-yloxyacetyl)propanehydrazide
CID 9368212
(2R)-N'-[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide
CID 7927374
(2R)-2-naphthalen-2-yloxy-N'-propanoylpropanehydrazide
CID 8757548
N'-[2-(2-bromo-4-ethylphenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide
CID 4940220
(2S)-N'-[(2R)-2-(2-methylphenoxy)propanoyl]-2-naphthalen-2-yloxypropanehydrazide
CID 8757616
N'-[3-(2-methoxyphenyl)propanoyl]-2-naphthalen-2-yloxypropanehydrazide
CID 55342358
methyl 4-[2-[(2S)-2-naphthalen-2-yloxypropanoyl]hydrazinyl]-4-oxobutanoate
CID 8757583
(2R)-N'-[2-(4-methoxyphenyl)acetyl]-2-naphthalen-2-yloxypropanehydrazide
CID 7927347
N'-[2-(2-methylphenoxy)acetyl]-2-(4-propan-2-ylphenoxy)propanehydrazide
CID 4953840
(2S)-N'-[(2R)-2-(2-chlorophenoxy)propanoyl]-2-naphthalen-2-yloxypropanehydrazide
CID 8757659

Frequently Asked Questions

What is the IUPAC name of (2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide?
The IUPAC name of (2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide (CID 8008591) is (2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide.
What is the SMILES notation for (2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide?
The canonical SMILES for (2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide is C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)COc1ccccc1C#N.
What is the InChIKey of (2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide?
The InChIKey is BXGCZKSYYYZVBL-OAHLLOKOSA-N. The full InChI is InChI=1S/C22H19N3O4/c1-15(29-19-11-10-16-6-2-3-7-17(16)12-19)22(27)25-24-21(26)14-28-20-9-5-4-8-18(20)13-23/h2-12,15H,14H2,1H3,(H,24,26)(H,25,27)/t15-/m1/s1.
What are the key properties of (2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide?
(2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide has a molecular weight of 389.41 g/mol, XLogP of 2.71, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N'-[2-(2-cyanophenoxy)acetyl]-2-naphthalen-2-yloxypropanehydrazide is sourced from PubChem (CID 8008591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).