N-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide

C13H19N3O3 — CID 15509074

IUPACN-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide
SMILESCOc1ccc(C(=O)NN)cc1NC(=O)C(C)(C)C
InChIInChI=1S/C13H19N3O3/c1-13(2,3)12(18)15-9-7-8(11(17)16-14)5-6-10(9)19-4/h5-7H,14H2,1-4H3,(H,15,18)(H,16,17)
InChIKeyKCUVZYXQGPJWHA-UHFFFAOYSA-N
MW265.31 g/mol
LogP1.28
Rot. Bonds3

About N-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide

N-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide (PubChem CID 15509074) has the molecular formula C13H19N3O3 and a molecular weight of 265.31 g/mol. Its IUPAC name is N-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide
PubChem CID15509074
Molecular FormulaC13H19N3O3
Molecular Weight265.31 g/mol
Exact Mass265.14
IUPAC NameN-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide
SMILESCOc1ccc(C(=O)NN)cc1NC(=O)C(C)(C)C
InChIInChI=1S/C13H19N3O3/c1-13(2,3)12(18)15-9-7-8(11(17)16-14)5-6-10(9)19-4/h5-7H,14H2,1-4H3,(H,15,18)(H,16,17)
InChIKeyKCUVZYXQGPJWHA-UHFFFAOYSA-N
XLogP1.28
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 51.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-methoxy-3-[(2,2,2-trifluoroacetyl)amino]benzamide
CID 63374757
N'-(2,2-dimethylpropanoyl)-3,4-dimethoxybenzohydrazide
CID 873947
5-(hydrazinecarbonyl)-2-methoxy-N-methylbenzenesulfonamide
CID 45373547
3-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]-4-methoxybenzoic acid
CID 28677113
[5-(hydrazinecarbonyl)-2-methoxyphenyl]methyl-trimethylazanium
CID 169283908
3-[(3-chloro-4-methoxybenzoyl)amino]-4-methoxybenzoic acid
CID 28673376
3-acetamido-4-methoxy-N-propylbenzamide
CID 110764204
3-[[(1S,3R)-3-carboxy-2,2-dimethylcyclopropanecarbonyl]amino]-4-methoxybenzoic acid
CID 95390850
N-(2,4-dimethoxyphenyl)-2,2-dimethylpropanamide
CID 3713993
3-[(2-amino-3,3-dimethylbutanoyl)amino]-4-methoxybenzamide
CID 76887811
3-acetamido-4-methoxy-N-(2-methylpropyl)benzamide
CID 110764209
N-[4-(2,2-dimethylpropanoylamino)-3-methylphenyl]-4-hydroxy-3-methoxybenzamide
CID 50956569

Frequently Asked Questions

What is the IUPAC name of N-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide (CID 15509074) is N-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide is COc1ccc(C(=O)NN)cc1NC(=O)C(C)(C)C.
What is the InChIKey of N-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide?
The InChIKey is KCUVZYXQGPJWHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3/c1-13(2,3)12(18)15-9-7-8(11(17)16-14)5-6-10(9)19-4/h5-7H,14H2,1-4H3,(H,15,18)(H,16,17).
What are the key properties of N-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide?
N-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide has a molecular weight of 265.31 g/mol, XLogP of 1.28, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(hydrazinecarbonyl)-2-methoxyphenyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 15509074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).