2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide

C14H13ClN2O2 — CID 4609056

IUPAC2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide
SMILESO=C(NNCc1ccc(O)cc1)c1ccccc1Cl
InChIInChI=1S/C14H13ClN2O2/c15-13-4-2-1-3-12(13)14(19)17-16-9-10-5-7-11(18)8-6-10/h1-8,16,18H,9H2,(H,17,19)
InChIKeyFIEPXYZPAOERGN-UHFFFAOYSA-N
MW276.72 g/mol
LogP2.48
Rot. Bonds4

About 2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide

2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide (PubChem CID 4609056) has the molecular formula C14H13ClN2O2 and a molecular weight of 276.72 g/mol. Its IUPAC name is 2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide.

Molecular Properties

Compound Name2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide
PubChem CID4609056
Molecular FormulaC14H13ClN2O2
Molecular Weight276.72 g/mol
Exact Mass276.07
IUPAC Name2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide
SMILESO=C(NNCc1ccc(O)cc1)c1ccccc1Cl
InChIInChI=1S/C14H13ClN2O2/c15-13-4-2-1-3-12(13)14(19)17-16-9-10-5-7-11(18)8-6-10/h1-8,16,18H,9H2,(H,17,19)
InChIKeyFIEPXYZPAOERGN-UHFFFAOYSA-N
XLogP2.48
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 52.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-hydroxy-N-[(4-hydroxyphenyl)methyl]benzamide
CID 47148502
N-[(4-aminophenyl)methyl]-2-chlorobenzamide
CID 39360992
2-[(4-hydroxyphenyl)methylcarbamoyl]benzoic acid
CID 110483824
N-[[4-(2-aminoethyl)phenyl]methyl]-2-chlorobenzamide
CID 62502652
2-chloro-N'-[2-(3,4-dichlorophenyl)acetyl]benzohydrazide
CID 2117207
2,6-dichloro-N'-(2-chlorobenzoyl)benzohydrazide
CID 78774908
2-chloro-N'-[(5-formyl-3-hydroxy-2-methyl-4-pyridinyl)methyl]benzohydrazide
CID 91310775
4-[[(2,6-dichlorophenyl)methylamino]methyl]phenol
CID 115603316
2-chloro-N-[2-[[4-(methoxymethyl)phenyl]methylamino]-2-oxoethyl]benzamide
CID 46415948
2-chloro-N'-[2-(2,6-dichlorophenyl)acetyl]benzohydrazide
CID 35929309
N'-(2-chlorobenzoyl)-2-propan-2-ylsulfanylbenzohydrazide
CID 51148209
3-[(2-chlorobenzoyl)amino]-1,1-diethylurea
CID 14173554

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide?
The IUPAC name of 2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide (CID 4609056) is 2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide.
What is the SMILES notation for 2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide?
The canonical SMILES for 2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide is O=C(NNCc1ccc(O)cc1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide?
The InChIKey is FIEPXYZPAOERGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O2/c15-13-4-2-1-3-12(13)14(19)17-16-9-10-5-7-11(18)8-6-10/h1-8,16,18H,9H2,(H,17,19).
What are the key properties of 2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide?
2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide has a molecular weight of 276.72 g/mol, XLogP of 2.48, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N'-[(4-hydroxyphenyl)methyl]benzohydrazide is sourced from PubChem (CID 4609056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).