N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide

C15H13IN2O3 — CID 149266850

IUPACN'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide
SMILESO=C(Cc1cccc(O)c1)NNC(=O)c1cccc(I)c1
InChIInChI=1S/C15H13IN2O3/c16-12-5-2-4-11(9-12)15(21)18-17-14(20)8-10-3-1-6-13(19)7-10/h1-7,9,19H,8H2,(H,17,20)(H,18,21)
InChIKeyXQHPHPDRNLCTOL-UHFFFAOYSA-N
MW396.18 g/mol
LogP2.00
Rot. Bonds3

About N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide

N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide (PubChem CID 149266850) has the molecular formula C15H13IN2O3 and a molecular weight of 396.18 g/mol. Its IUPAC name is N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide.

Molecular Properties

Compound NameN'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide
PubChem CID149266850
Molecular FormulaC15H13IN2O3
Molecular Weight396.18 g/mol
Exact Mass396.00
IUPAC NameN'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide
SMILESO=C(Cc1cccc(O)c1)NNC(=O)c1cccc(I)c1
InChIInChI=1S/C15H13IN2O3/c16-12-5-2-4-11(9-12)15(21)18-17-14(20)8-10-3-1-6-13(19)7-10/h1-7,9,19H,8H2,(H,17,20)(H,18,21)
InChIKeyXQHPHPDRNLCTOL-UHFFFAOYSA-N
XLogP2.00
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.18
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(chloromethyl)-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide
CID 59422014
methyl 4-[[[2-(3-hydroxyphenyl)acetyl]amino]carbamoyl]benzoate
CID 59421998
N'-[2-(4-bromophenyl)acetyl]-3-hydroxybenzohydrazide
CID 17457296
N'-[2-(3-hydroxyphenyl)acetyl]-3,5-dinitrobenzohydrazide
CID 59421966
N-hydroxy-4-[[[2-(3-hydroxyphenyl)acetyl]amino]carbamoyl]benzeneamine oxide
CID 89245814
2-iodo-N'-(3-iodobenzoyl)benzohydrazide
CID 4236537
N'-(2-chloroacetyl)-3-hydroxybenzohydrazide
CID 166407635
2-fluoro-N'-[2-(3-hydroxyphenyl)acetyl]benzohydrazide
CID 59422019
3-iodo-N'-(4-methylbenzoyl)benzohydrazide
CID 1127160
N'-(3-iodobenzoyl)pyridine-4-carbohydrazide
CID 3280219
N'-[2-(3-fluorophenyl)acetyl]benzohydrazide
CID 9414915
2-[3-[(3-iodobenzoyl)amino]phenyl]acetic acid
CID 65346308

Frequently Asked Questions

What is the IUPAC name of N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide?
The IUPAC name of N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide (CID 149266850) is N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide.
What is the SMILES notation for N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide?
The canonical SMILES for N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide is O=C(Cc1cccc(O)c1)NNC(=O)c1cccc(I)c1.
What is the InChIKey of N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide?
The InChIKey is XQHPHPDRNLCTOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13IN2O3/c16-12-5-2-4-11(9-12)15(21)18-17-14(20)8-10-3-1-6-13(19)7-10/h1-7,9,19H,8H2,(H,17,20)(H,18,21).
What are the key properties of N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide?
N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide has a molecular weight of 396.18 g/mol, XLogP of 2.00, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(3-hydroxyphenyl)acetyl]-3-iodobenzohydrazide is sourced from PubChem (CID 149266850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).