formohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol

C17H23N3O3 — CID 144784892

IUPACformohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol
SMILESCNc1cccc(C)c1COc1ccc(O)cc1C.NNC=O
InChIInChI=1S/C16H19NO2.CH4N2O/c1-11-5-4-6-15(17-3)14(11)10-19-16-8-7-13(18)9-12(16)2;2-3-1-4/h4-9,17-18H,10H2,1-3H3;1H,2H2,(H,3,4)
InChIKeyKJXGMAXBEHTMBM-UHFFFAOYSA-N
MW317.39 g/mol
LogP2.24
Rot. Bonds5

About formohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol

formohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol (PubChem CID 144784892) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is formohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol.

Molecular Properties

Compound Nameformohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol
PubChem CID144784892
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC Nameformohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol
SMILESCNc1cccc(C)c1COc1ccc(O)cc1C.NNC=O
InChIInChI=1S/C16H19NO2.CH4N2O/c1-11-5-4-6-15(17-3)14(11)10-19-16-8-7-13(18)9-12(16)2;2-3-1-4/h4-9,17-18H,10H2,1-3H3;1H,2H2,(H,3,4)
InChIKeyKJXGMAXBEHTMBM-UHFFFAOYSA-N
XLogP2.24
TPSA96.61 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 52.24
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol
CID 129110182
2-[[4-(5-chloro-2-pyridinyl)-2-methylphenoxy]methyl]-N,3-dimethylaniline;formohydrazide
CID 144772924
[3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenyl]-phenylmethanone
CID 144659514
4-[(2-amino-6-methylphenyl)methoxy]-3-methylphenol
CID 129110100
2-[(3,6-dimethyl-5-phenyl-2-pyridinyl)oxymethyl]-N,3-dimethylaniline;formohydrazide
CID 144784393
2-[(6-ethyl-2-pyridinyl)oxymethyl]-N,3-dimethylaniline;formohydrazide
CID 144784105
N,3-dimethyl-2-[(2-methyl-4-phenoxyphenoxy)methyl]aniline
CID 144784982
N-chloro-2-[(4-hydroxy-2-methylphenoxy)methyl]-3-methylbenzamide
CID 129110227
N,3-dimethyl-2-[(2-methyl-4-pentan-2-ylphenoxy)methyl]aniline
CID 144784724
3-bromo-2-[(3,6-dimethyl-2-pyridinyl)oxymethyl]-N-methylaniline;formohydrazide
CID 144784046
3-chloro-2-[[4-[(Z)-2-ethylsulfanyl-1-(methylideneamino)prop-1-enyl]-2-methylphenoxy]methyl]-N-methylaniline;formohydrazide
CID 144799641
4-[[2-[amino(methyl)amino]-6-methylphenyl]methoxy]-N,3-dimethyl-N-phenylaniline;formohydrazide
CID 144784749

Frequently Asked Questions

What is the IUPAC name of formohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol?
The IUPAC name of formohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol (CID 144784892) is formohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol.
What is the SMILES notation for formohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol?
The canonical SMILES for formohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol is CNc1cccc(C)c1COc1ccc(O)cc1C.NNC=O.
What is the InChIKey of formohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol?
The InChIKey is KJXGMAXBEHTMBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2.CH4N2O/c1-11-5-4-6-15(17-3)14(11)10-19-16-8-7-13(18)9-12(16)2;2-3-1-4/h4-9,17-18H,10H2,1-3H3;1H,2H2,(H,3,4).
What are the key properties of formohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol?
formohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol has a molecular weight of 317.39 g/mol, XLogP of 2.24, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for formohydrazide;3-methyl-4-[[2-methyl-6-(methylamino)phenyl]methoxy]phenol is sourced from PubChem (CID 144784892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).