N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide

C13H20N2O2 — CID 116846698

IUPACN'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide
SMILESCNNC(=O)COCc1ccc(C(C)C)cc1
InChIInChI=1S/C13H20N2O2/c1-10(2)12-6-4-11(5-7-12)8-17-9-13(16)15-14-3/h4-7,10,14H,8-9H2,1-3H3,(H,15,16)
InChIKeySWNHIIJWSYBGCA-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.58
Rot. Bonds6

About N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide

N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide (PubChem CID 116846698) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide.

Molecular Properties

Compound NameN'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide
PubChem CID116846698
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC NameN'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide
SMILESCNNC(=O)COCc1ccc(C(C)C)cc1
InChIInChI=1S/C13H20N2O2/c1-10(2)12-6-4-11(5-7-12)8-17-9-13(16)15-14-3/h4-7,10,14H,8-9H2,1-3H3,(H,15,16)
InChIKeySWNHIIJWSYBGCA-UHFFFAOYSA-N
XLogP1.58
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.58
H-Bond Donors ≤ 52
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-[(4-tert-butylphenyl)methoxy]-N'-methylacetohydrazide
CID 116846699
2-[(4-ethoxyphenyl)methoxy]-N'-methylacetohydrazide
CID 116846735
2-[(3,4-dimethylphenyl)methoxy]-N'-methylacetohydrazide
CID 116846700
(4-propan-2-ylphenyl)methyl 2-methylpropanoate
CID 58781802
N-methyl-3-(4-propan-2-ylphenyl)propanamide
CID 41455606
(4-propan-2-ylphenyl)methyl nitrate
CID 14545608
N-[(2S)-butan-2-yl]-2-phenylmethoxyacetamide
CID 95358537
N'-methyl-2-[(2-oxo-3H-1,3-benzoxazol-5-yl)methoxy]acetohydrazide
CID 116846784
N-[1-(4-chlorophenyl)propyl]-2-phenylmethoxyacetamide
CID 55497591
N'-methyl-2-propan-2-yloxyacetohydrazide
CID 116820653
N-(3-methyl-1-phenylbutyl)-2-phenylmethoxyacetamide
CID 55371721
N-[2-[[2-(2-methoxyethoxy)acetyl]amino]ethyl]-4-propan-2-ylbenzamide
CID 108574844

Frequently Asked Questions

What is the IUPAC name of N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide?
The IUPAC name of N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide (CID 116846698) is N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide.
What is the SMILES notation for N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide?
The canonical SMILES for N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide is CNNC(=O)COCc1ccc(C(C)C)cc1.
What is the InChIKey of N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide?
The InChIKey is SWNHIIJWSYBGCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10(2)12-6-4-11(5-7-12)8-17-9-13(16)15-14-3/h4-7,10,14H,8-9H2,1-3H3,(H,15,16).
What are the key properties of N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide?
N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide has a molecular weight of 236.31 g/mol, XLogP of 1.58, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-2-[(4-propan-2-ylphenyl)methoxy]acetohydrazide is sourced from PubChem (CID 116846698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).