4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide

C20H24N2O4 — CID 4936338

IUPAC4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide
SMILESCCCCOc1ccc(C(=O)NNC(=O)Cc2ccc(OC)cc2)cc1
InChIInChI=1S/C20H24N2O4/c1-3-4-13-26-18-11-7-16(8-12-18)20(24)22-21-19(23)14-15-5-9-17(25-2)10-6-15/h5-12H,3-4,13-14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyRVNCZPKHKGWCJD-UHFFFAOYSA-N
MW356.42 g/mol
LogP2.88
Rot. Bonds8

About 4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide

4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide (PubChem CID 4936338) has the molecular formula C20H24N2O4 and a molecular weight of 356.42 g/mol. Its IUPAC name is 4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide.

Molecular Properties

Compound Name4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide
PubChem CID4936338
Molecular FormulaC20H24N2O4
Molecular Weight356.42 g/mol
Exact Mass356.17
IUPAC Name4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide
SMILESCCCCOc1ccc(C(=O)NNC(=O)Cc2ccc(OC)cc2)cc1
InChIInChI=1S/C20H24N2O4/c1-3-4-13-26-18-11-7-16(8-12-18)20(24)22-21-19(23)14-15-5-9-17(25-2)10-6-15/h5-12H,3-4,13-14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyRVNCZPKHKGWCJD-UHFFFAOYSA-N
XLogP2.88
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.42
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(2-phenylacetyl)-4-propoxybenzohydrazide
CID 4938615
4-tert-butyl-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide
CID 795496
N'-butanoyl-4-butoxybenzohydrazide
CID 17340318
4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide
CID 9492733
4-hexoxy-N'-[2-(3,4,5-trimethoxyphenyl)acetyl]benzohydrazide
CID 24677365
N-[4-[[[2-(4-methoxyphenyl)acetyl]amino]carbamoyl]phenyl]butanamide
CID 1011747
N'-(4-butoxybenzoyl)-4-ethoxybenzohydrazide
CID 7979581
4-ethoxy-N'-[2-(4-hydroxyphenyl)acetyl]benzohydrazide
CID 78821862
N'-[2-(4-ethoxyphenyl)acetyl]-4-ethylbenzohydrazide
CID 78780592
4-[(4-methoxyphenyl)diazenyl]-N'-(4-octoxybenzoyl)benzohydrazide
CID 137270173
4-butoxy-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 7997659
N'-heptanoyl-4-hexoxybenzohydrazide
CID 54789289

Frequently Asked Questions

What is the IUPAC name of 4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide?
The IUPAC name of 4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide (CID 4936338) is 4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide.
What is the SMILES notation for 4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide?
The canonical SMILES for 4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide is CCCCOc1ccc(C(=O)NNC(=O)Cc2ccc(OC)cc2)cc1.
What is the InChIKey of 4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide?
The InChIKey is RVNCZPKHKGWCJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4/c1-3-4-13-26-18-11-7-16(8-12-18)20(24)22-21-19(23)14-15-5-9-17(25-2)10-6-15/h5-12H,3-4,13-14H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of 4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide?
4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide has a molecular weight of 356.42 g/mol, XLogP of 2.88, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide is sourced from PubChem (CID 4936338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).