(2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide

C20H24N2O4 — CID 9297891

IUPAC(2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide
SMILESCc1ccc(OCC(=O)NNC(=O)[C@@H](C)Oc2c(C)cccc2C)cc1
InChIInChI=1S/C20H24N2O4/c1-13-8-10-17(11-9-13)25-12-18(23)21-22-20(24)16(4)26-19-14(2)6-5-7-15(19)3/h5-11,16H,12H2,1-4H3,(H,21,23)(H,22,24)/t16-/m1/s1
InChIKeyQRNSXGBXBCEEFK-MRXNPFEDSA-N
MW356.42 g/mol
LogP2.61
Rot. Bonds6

About (2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide

(2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide (PubChem CID 9297891) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is (2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide.

Molecular Properties

Compound Name(2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide
PubChem CID9297891
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name(2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide
SMILESCc1ccc(OCC(=O)NNC(=O)[C@@H](C)Oc2c(C)cccc2C)cc1
InChIInChI=1S/C20H24N2O4/c1-13-8-10-17(11-9-13)25-12-18(23)21-22-20(24)16(4)26-19-14(2)6-5-7-15(19)3/h5-11,16H,12H2,1-4H3,(H,21,23)(H,22,24)/t16-/m1/s1
InChIKeyQRNSXGBXBCEEFK-MRXNPFEDSA-N
XLogP2.61
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-(2,6-dimethylphenoxy)-N'-(2-phenoxyacetyl)propanehydrazide
CID 9297829
propyl 4-[2-[2-[2-(2,6-dimethylphenoxy)propanoyl]hydrazinyl]-2-oxoethoxy]benzoate
CID 4958742
N'-[2-(2,6-dimethylphenoxy)acetyl]-2-(4-phenylphenoxy)propanehydrazide
CID 4951968
N'-[2-(2-bromo-4-methylphenoxy)acetyl]-2-(2,6-dimethylphenoxy)propanehydrazide
CID 4958704
(2S)-2-(2,6-dimethylphenoxy)-N'-[2-(2-propan-2-ylphenoxy)acetyl]propanehydrazide
CID 9297781
N'-[2-(2,6-dimethylphenoxy)acetyl]-2-(4-propan-2-ylphenoxy)acetohydrazide
CID 2210337
2-(2,3-dimethylphenoxy)-N'-[2-(4-ethylphenoxy)acetyl]propanehydrazide
CID 55341964
(2R)-2-(2,4-dichlorophenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide
CID 7728372
2-methyl-N'-[2-[4-(4-methylphenoxy)phenoxy]acetyl]propanehydrazide
CID 24633512
2-(4-bromo-2,6-dimethylphenoxy)-N'-[2-(2-methylphenoxy)acetyl]propanehydrazide
CID 4961130
N'-[2-(3-methylphenoxy)acetyl]-2-(4-propan-2-ylphenoxy)propanehydrazide
CID 4953842
2-(4-fluorophenoxy)-N'-[2-(3-methylphenoxy)acetyl]propanehydrazide
CID 24638267

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide?
The IUPAC name of (2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide (CID 9297891) is (2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide.
What is the SMILES notation for (2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide?
The canonical SMILES for (2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide is Cc1ccc(OCC(=O)NNC(=O)[C@@H](C)Oc2c(C)cccc2C)cc1.
What is the InChIKey of (2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide?
The InChIKey is QRNSXGBXBCEEFK-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-13-8-10-17(11-9-13)25-12-18(23)21-22-20(24)16(4)26-19-14(2)6-5-7-15(19)3/h5-11,16H,12H2,1-4H3,(H,21,23)(H,22,24)/t16-/m1/s1.
What are the key properties of (2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide?
(2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide has a molecular weight of 356.42 g/mol, XLogP of 2.61, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2,6-dimethylphenoxy)-N'-[2-(4-methylphenoxy)acetyl]propanehydrazide is sourced from PubChem (CID 9297891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).