3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide

C18H23N3O2 — CID 143213338

IUPAC3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide
SMILESCOc1cccc(-c2cc(C(C)(CC(N)=O)NN)ccc2C)c1
InChIInChI=1S/C18H23N3O2/c1-12-7-8-14(18(2,21-20)11-17(19)22)10-16(12)13-5-4-6-15(9-13)23-3/h4-10,21H,11,20H2,1-3H3,(H2,19,22)
InChIKeyWQATTXMCIHBIEA-UHFFFAOYSA-N
MW313.40 g/mol
LogP2.22
Rot. Bonds6

About 3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide

3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide (PubChem CID 143213338) has the molecular formula C18H23N3O2 and a molecular weight of 313.40 g/mol. Its IUPAC name is 3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide.

Molecular Properties

Compound Name3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide
PubChem CID143213338
Molecular FormulaC18H23N3O2
Molecular Weight313.40 g/mol
Exact Mass313.18
IUPAC Name3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide
SMILESCOc1cccc(-c2cc(C(C)(CC(N)=O)NN)ccc2C)c1
InChIInChI=1S/C18H23N3O2/c1-12-7-8-14(18(2,21-20)11-17(19)22)10-16(12)13-5-4-6-15(9-13)23-3/h4-10,21H,11,20H2,1-3H3,(H2,19,22)
InChIKeyWQATTXMCIHBIEA-UHFFFAOYSA-N
XLogP2.22
TPSA90.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 52.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[4-chloro-3-(3-methoxyphenyl)phenyl]-3-hydrazinylbutanamide
CID 143213390
2-(3-methoxyphenyl)-1,4-dimethylbenzene
CID 66641424
2-(3-methoxyphenyl)-1-methyl-4-nitrobenzene
CID 125478687
3-(4-methoxyphenyl)-3-methylbutanamide
CID 50995659
[4-tert-butyl-2-(3-methoxyphenyl)phenyl] N,N-diethylcarbamate
CID 44551915
2-[2-(3-methoxyphenyl)phenyl]acetic acid
CID 2759556
4-amino-2-(3-methoxyphenyl)benzoic acid
CID 82293595
2-[2-(3-methoxyphenyl)phenyl]-2-methylpropanoic acid
CID 39232932
3-(ethylamino)-3-(6-methoxynaphthalen-2-yl)butanoic acid
CID 65234037
methyl 2-hydrazinyl-2-(3-methoxyphenyl)propanoate;hydrochloride
CID 155757771
3-(3-methoxyanilino)propanamide
CID 43131962
2-fluoro-4-(3-methoxyphenyl)-5-methylaniline
CID 68764353

Frequently Asked Questions

What is the IUPAC name of 3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide?
The IUPAC name of 3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide (CID 143213338) is 3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide.
What is the SMILES notation for 3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide?
The canonical SMILES for 3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide is COc1cccc(-c2cc(C(C)(CC(N)=O)NN)ccc2C)c1.
What is the InChIKey of 3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide?
The InChIKey is WQATTXMCIHBIEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O2/c1-12-7-8-14(18(2,21-20)11-17(19)22)10-16(12)13-5-4-6-15(9-13)23-3/h4-10,21H,11,20H2,1-3H3,(H2,19,22).
What are the key properties of 3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide?
3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide has a molecular weight of 313.40 g/mol, XLogP of 2.22, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydrazinyl-3-[3-(3-methoxyphenyl)-4-methylphenyl]butanamide is sourced from PubChem (CID 143213338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).