(2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide

C18H19N3O7 — CID 9206073

IUPAC(2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide
SMILESCOc1ccccc1OCC(=O)NNC(=O)[C@@H](C)Oc1ccccc1[N+](=O)[O-]
InChIInChI=1S/C18H19N3O7/c1-12(28-14-8-4-3-7-13(14)21(24)25)18(23)20-19-17(22)11-27-16-10-6-5-9-15(16)26-2/h3-10,12H,11H2,1-2H3,(H,19,22)(H,20,23)/t12-/m1/s1
InChIKeyYJRJZFZEGYIZFR-GFCCVEGCSA-N
MW389.36 g/mol
LogP1.60
Rot. Bonds8

About (2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide

(2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide (PubChem CID 9206073) has the molecular formula C18H19N3O7 and a molecular weight of 389.36 g/mol. Its IUPAC name is (2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide.

Molecular Properties

Compound Name(2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide
PubChem CID9206073
Molecular FormulaC18H19N3O7
Molecular Weight389.36 g/mol
Exact Mass389.12
IUPAC Name(2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide
SMILESCOc1ccccc1OCC(=O)NNC(=O)[C@@H](C)Oc1ccccc1[N+](=O)[O-]
InChIInChI=1S/C18H19N3O7/c1-12(28-14-8-4-3-7-13(14)21(24)25)18(23)20-19-17(22)11-27-16-10-6-5-9-15(16)26-2/h3-10,12H,11H2,1-2H3,(H,19,22)(H,20,23)/t12-/m1/s1
InChIKeyYJRJZFZEGYIZFR-GFCCVEGCSA-N
XLogP1.60
TPSA129.03 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.36
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(2-bromo-4-methylphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide
CID 4944233
(2R)-N'-[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide
CID 9206084
N'-[2-(3-methylphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide
CID 4944192
3,4-dimethoxy-N'-[2-(2-nitrophenoxy)acetyl]benzohydrazide
CID 4931330
methyl 2-[[2-(2-nitrophenoxy)acetyl]amino]propanoate
CID 60637868
N-[(1R)-1-(2-methoxyphenyl)ethyl]-2-(2-nitrophenoxy)acetamide
CID 7719046
2-nitro-N'-[2-(2-nitrophenoxy)propanoyl]benzohydrazide
CID 4944143
N-(3,4-dimethoxyphenyl)-2-(2-nitrophenoxy)acetamide
CID 2500616
2-(2-butan-2-ylphenoxy)-N'-[2-(2-methoxyphenoxy)acetyl]propanehydrazide
CID 17130025
2-(4-methoxyphenyl)-N'-[2-(2-nitrophenoxy)acetyl]acetohydrazide
CID 4931201
2-(2-methoxyphenoxy)-N'-[2-(4-phenylphenoxy)acetyl]propanehydrazide
CID 4943458
(2S)-2-(2-nitrophenoxy)propanoic acid
CID 841636

Frequently Asked Questions

What is the IUPAC name of (2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide?
The IUPAC name of (2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide (CID 9206073) is (2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide.
What is the SMILES notation for (2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide?
The canonical SMILES for (2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide is COc1ccccc1OCC(=O)NNC(=O)[C@@H](C)Oc1ccccc1[N+](=O)[O-].
What is the InChIKey of (2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide?
The InChIKey is YJRJZFZEGYIZFR-GFCCVEGCSA-N. The full InChI is InChI=1S/C18H19N3O7/c1-12(28-14-8-4-3-7-13(14)21(24)25)18(23)20-19-17(22)11-27-16-10-6-5-9-15(16)26-2/h3-10,12H,11H2,1-2H3,(H,19,22)(H,20,23)/t12-/m1/s1.
What are the key properties of (2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide?
(2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide has a molecular weight of 389.36 g/mol, XLogP of 1.60, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N'-[2-(2-methoxyphenoxy)acetyl]-2-(2-nitrophenoxy)propanehydrazide is sourced from PubChem (CID 9206073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).