2-chloro-N'-(4-methoxyphenyl)propanehydrazide

C10H13ClN2O2 — CID 141429195

IUPAC2-chloro-N'-(4-methoxyphenyl)propanehydrazide
SMILESCOc1ccc(NNC(=O)C(C)Cl)cc1
InChIInChI=1S/C10H13ClN2O2/c1-7(11)10(14)13-12-8-3-5-9(15-2)6-4-8/h3-7,12H,1-2H3,(H,13,14)
InChIKeyYBABCVRTDFUJIQ-UHFFFAOYSA-N
MW228.68 g/mol
LogP1.77
Rot. Bonds4

About 2-chloro-N'-(4-methoxyphenyl)propanehydrazide

2-chloro-N'-(4-methoxyphenyl)propanehydrazide (PubChem CID 141429195) has the molecular formula C10H13ClN2O2 and a molecular weight of 228.68 g/mol. Its IUPAC name is 2-chloro-N'-(4-methoxyphenyl)propanehydrazide.

Molecular Properties

Compound Name2-chloro-N'-(4-methoxyphenyl)propanehydrazide
PubChem CID141429195
Molecular FormulaC10H13ClN2O2
Molecular Weight228.68 g/mol
Exact Mass228.07
IUPAC Name2-chloro-N'-(4-methoxyphenyl)propanehydrazide
SMILESCOc1ccc(NNC(=O)C(C)Cl)cc1
InChIInChI=1S/C10H13ClN2O2/c1-7(11)10(14)13-12-8-3-5-9(15-2)6-4-8/h3-7,12H,1-2H3,(H,13,14)
InChIKeyYBABCVRTDFUJIQ-UHFFFAOYSA-N
XLogP1.77
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.68
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-amino-N'-(4-methoxyphenyl)-3-methylpentanehydrazide
CID 68721410
(2R)-2-chloro-N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]propanamide
CID 1000043
3,4-dichloro-N'-(4-methoxyphenyl)benzohydrazide
CID 122371137
(2S)-2-chloro-N-(3-methoxyphenyl)propanamide
CID 6591303
2-(4-hydroxyphenyl)-N'-(4-methoxyphenyl)acetohydrazide
CID 86181946
1-methoxy-4-[2-(4-methoxyanilino)hydrazinyl]benzene
CID 163682432
1-chloro-2-(4-methoxyphenyl)hydrazine;sulfuric acid
CID 175006375
methyl N-[4-(2-chloropropanoylamino)phenyl]carbamate
CID 43701229
1,3-bis(4-methoxyphenyl)urea
CID 139045428
1-chloro-2-(4-methoxyphenyl)hydrazine;hydrobromide
CID 175005473
2-chloro-N-[2-(2-hydroxy-4-methoxyphenyl)ethyl]propanamide
CID 82109866
N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide
CID 2789590

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N'-(4-methoxyphenyl)propanehydrazide?
The IUPAC name of 2-chloro-N'-(4-methoxyphenyl)propanehydrazide (CID 141429195) is 2-chloro-N'-(4-methoxyphenyl)propanehydrazide.
What is the SMILES notation for 2-chloro-N'-(4-methoxyphenyl)propanehydrazide?
The canonical SMILES for 2-chloro-N'-(4-methoxyphenyl)propanehydrazide is COc1ccc(NNC(=O)C(C)Cl)cc1.
What is the InChIKey of 2-chloro-N'-(4-methoxyphenyl)propanehydrazide?
The InChIKey is YBABCVRTDFUJIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O2/c1-7(11)10(14)13-12-8-3-5-9(15-2)6-4-8/h3-7,12H,1-2H3,(H,13,14).
What are the key properties of 2-chloro-N'-(4-methoxyphenyl)propanehydrazide?
2-chloro-N'-(4-methoxyphenyl)propanehydrazide has a molecular weight of 228.68 g/mol, XLogP of 1.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N'-(4-methoxyphenyl)propanehydrazide is sourced from PubChem (CID 141429195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).