2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide

C16H19N3O2 — CID 82453181

IUPAC2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide
SMILESCc1nc(-c2ccc(OC(C)C)cc2)ccc1C(=O)NN
InChIInChI=1S/C16H19N3O2/c1-10(2)21-13-6-4-12(5-7-13)15-9-8-14(11(3)18-15)16(20)19-17/h4-10H,17H2,1-3H3,(H,19,20)
InChIKeyIWUFALSYNCHAQG-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.45
Rot. Bonds4

About 2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide

2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide (PubChem CID 82453181) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide.

Molecular Properties

Compound Name2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide
PubChem CID82453181
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide
SMILESCc1nc(-c2ccc(OC(C)C)cc2)ccc1C(=O)NN
InChIInChI=1S/C16H19N3O2/c1-10(2)21-13-6-4-12(5-7-13)15-9-8-14(11(3)18-15)16(20)19-17/h4-10H,17H2,1-3H3,(H,19,20)
InChIKeyIWUFALSYNCHAQG-UHFFFAOYSA-N
XLogP2.45
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.45
H-Bond Donors ≤ 52
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

6-(4-chlorophenyl)-2-methylpyridine-3-carbohydrazide
CID 53433276
ethyl 6-(4-ethoxyphenyl)-2-methylpyridine-3-carboxylate
CID 115917504
2-methyl-6-propan-2-ylpyridine-3-carbohydrazide
CID 82452163
N-[(2S)-1-aminopropan-2-yl]-2-methyl-6-phenylpyridine-3-carboxamide
CID 120508416
sodium 6-(4-methoxyphenyl)-2-methylpyridine-3-carboxylate
CID 155928034
6-[4-[[[2-(4-methoxyphenyl)acetyl]amino]methyl]phenyl]-N,2-dimethylpyridine-3-carboxamide
CID 92620909
6-[4-[[[(2R)-2-(3,4-dimethylphenoxy)propanoyl]amino]methyl]phenyl]-N,2-dimethylpyridine-3-carboxamide
CID 92620815
2-bromo-1-[2-methyl-6-[4-(4-methylphenoxy)phenyl]-3-pyridinyl]ethanone
CID 91871576
1-[6-(4-chlorophenyl)-2-methyl-3-pyridinyl]ethanone
CID 11043024
N-(6-amino-2-methyl-3-pyridinyl)-4-propan-2-yloxybenzamide
CID 82331090
N-(2-amino-1-cyclopropylethyl)-2-methyl-6-phenylpyridine-3-carboxamide
CID 119615030
[2-[di(propan-2-yl)amino]-2-oxoethyl] 2-methyl-6-phenylpyridine-3-carboxylate
CID 55463613

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide?
The IUPAC name of 2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide (CID 82453181) is 2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide.
What is the SMILES notation for 2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide?
The canonical SMILES for 2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide is Cc1nc(-c2ccc(OC(C)C)cc2)ccc1C(=O)NN.
What is the InChIKey of 2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide?
The InChIKey is IWUFALSYNCHAQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-10(2)21-13-6-4-12(5-7-13)15-9-8-14(11(3)18-15)16(20)19-17/h4-10H,17H2,1-3H3,(H,19,20).
What are the key properties of 2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide?
2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide has a molecular weight of 285.35 g/mol, XLogP of 2.45, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(4-propan-2-yloxyphenyl)pyridine-3-carbohydrazide is sourced from PubChem (CID 82453181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).