3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide

C25H26N2O4 — CID 25443034

IUPAC3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide
SMILESCCCOc1ccc(C(=O)NNC(=O)Cc2ccc(-c3ccccc3)cc2)cc1OC
InChIInChI=1S/C25H26N2O4/c1-3-15-31-22-14-13-21(17-23(22)30-2)25(29)27-26-24(28)16-18-9-11-20(12-10-18)19-7-5-4-6-8-19/h4-14,17H,3,15-16H2,1-2H3,(H,26,28)(H,27,29)
InChIKeyUFZGMRKDQFTGCF-UHFFFAOYSA-N
MW418.49 g/mol
LogP4.15
Rot. Bonds8

About 3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide

3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide (PubChem CID 25443034) has the molecular formula C25H26N2O4 and a molecular weight of 418.49 g/mol. Its IUPAC name is 3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide.

Molecular Properties

Compound Name3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide
PubChem CID25443034
Molecular FormulaC25H26N2O4
Molecular Weight418.49 g/mol
Exact Mass418.19
IUPAC Name3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide
SMILESCCCOc1ccc(C(=O)NNC(=O)Cc2ccc(-c3ccccc3)cc2)cc1OC
InChIInChI=1S/C25H26N2O4/c1-3-15-31-22-14-13-21(17-23(22)30-2)25(29)27-26-24(28)16-18-9-11-20(12-10-18)19-7-5-4-6-8-19/h4-14,17H,3,15-16H2,1-2H3,(H,26,28)(H,27,29)
InChIKeyUFZGMRKDQFTGCF-UHFFFAOYSA-N
XLogP4.15
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.49
LogP ≤ 54.15
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

N'-benzoyl-4-butoxy-3-methoxybenzohydrazide
CID 9440054
N'-benzoyl-3,4-dipropoxybenzohydrazide
CID 8574890
4-ethoxy-3-methoxy-N'-(2-naphthalen-2-ylacetyl)benzohydrazide
CID 9439837
3-methoxy-4-propoxy-N'-[2-[2-(trifluoromethyl)phenoxy]acetyl]benzohydrazide
CID 55616585
N-[2-(3-methoxy-4-propoxyphenyl)ethyl]-2-phenylacetamide
CID 141386663
N'-(3-chlorobenzoyl)-3-methoxy-4-propoxybenzohydrazide
CID 26621830
N'-(2-phenylacetyl)-4-propoxybenzohydrazide
CID 4938615
3,4-dimethoxy-N'-[2-(2-methoxyphenyl)acetyl]benzohydrazide
CID 24645288
3-methoxy-N'-(4-methylsulfanylbenzoyl)-4-propoxybenzohydrazide
CID 8621227
N'-[2-(2-ethoxyphenoxy)acetyl]-3,4-dipropoxybenzohydrazide
CID 55358632
N'-[4-(dimethylamino)benzoyl]-3-methoxy-4-propoxybenzohydrazide
CID 25443040
N'-(4-butoxy-3-methoxybenzoyl)-3-phenyl-1H-pyrazole-5-carbohydrazide
CID 8889507

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide?
The IUPAC name of 3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide (CID 25443034) is 3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide.
What is the SMILES notation for 3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide?
The canonical SMILES for 3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide is CCCOc1ccc(C(=O)NNC(=O)Cc2ccc(-c3ccccc3)cc2)cc1OC.
What is the InChIKey of 3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide?
The InChIKey is UFZGMRKDQFTGCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N2O4/c1-3-15-31-22-14-13-21(17-23(22)30-2)25(29)27-26-24(28)16-18-9-11-20(12-10-18)19-7-5-4-6-8-19/h4-14,17H,3,15-16H2,1-2H3,(H,26,28)(H,27,29).
What are the key properties of 3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide?
3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide has a molecular weight of 418.49 g/mol, XLogP of 4.15, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N'-[2-(4-phenylphenyl)acetyl]-4-propoxybenzohydrazide is sourced from PubChem (CID 25443034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).