N-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide

C12H14N6O3 — CID 146381550

IUPACN-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide
SMILESCOc1nn(C)cc1C(=O)Nc1cccc(C(=O)NN)n1
InChIInChI=1S/C12H14N6O3/c1-18-6-7(12(17-18)21-2)10(19)15-9-5-3-4-8(14-9)11(20)16-13/h3-6H,13H2,1-2H3,(H,16,20)(H,14,15,19)
InChIKeyOCUBZXDIWOPORU-UHFFFAOYSA-N
MW290.28 g/mol
LogP-0.32
Rot. Bonds4

About N-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide

N-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide (PubChem CID 146381550) has the molecular formula C12H14N6O3 and a molecular weight of 290.28 g/mol. Its IUPAC name is N-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide
PubChem CID146381550
Molecular FormulaC12H14N6O3
Molecular Weight290.28 g/mol
Exact Mass290.11
IUPAC NameN-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide
SMILESCOc1nn(C)cc1C(=O)Nc1cccc(C(=O)NN)n1
InChIInChI=1S/C12H14N6O3/c1-18-6-7(12(17-18)21-2)10(19)15-9-5-3-4-8(14-9)11(20)16-13/h3-6H,13H2,1-2H3,(H,16,20)(H,14,15,19)
InChIKeyOCUBZXDIWOPORU-UHFFFAOYSA-N
XLogP-0.32
TPSA124.16 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.28
LogP ≤ 5-0.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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

N-[6-[4-[(2S)-1,1-difluoropropan-2-yl]-1,2,4-triazol-3-yl]-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide
CID 146381600
3-methoxy-1-methyl-N-[6-[4-[(3R)-oxolan-3-yl]-1,2,4-triazol-3-yl]-2-pyridinyl]pyrazole-4-carboxamide
CID 146381583
N-[3-chloro-2-(methoxymethyl)phenyl]-3-methoxy-1-methylpyrazole-4-carboxamide
CID 167851785
N-(4-ethyl-1,3-benzothiazol-2-yl)-3-methoxy-1-methylpyrazole-4-carboxamide
CID 43989583
3-methoxy-1-methyl-N-[4-(1,2-oxazol-3-ylcarbamoyl)phenyl]pyrazole-4-carboxamide
CID 121079977
3-methoxy-1-methyl-N-[4-(trifluoromethoxy)phenyl]pyrazole-4-carboxamide
CID 16809642
3-amino-1-(3-methoxy-1-methylpyrazol-4-yl)propan-1-one
CID 82601683
3-ethoxy-N-[6-(4-ethyl-1,2,4-triazol-3-yl)-2-pyridinyl]-1-methylpyrazole-4-carboxamide
CID 146393281
N-[2-(2,3-dichloroanilino)-2-oxoethyl]-3-methoxy-1-methylpyrazole-4-carboxamide
CID 121091914
3-methoxy-1-methyl-N-(2-methylsulfanyl-[1,3]thiazolo[4,5-g][1,3]benzothiazol-7-yl)pyrazole-4-carboxamide
CID 45497408
N-(5-acetamido-2-methoxyphenyl)-3-methoxy-1-methylpyrazole-4-carboxamide
CID 16820968
N-(3-cyclopropyl-1-methylpyrazol-4-yl)-3-methoxy-1-methylpyrazole-4-carboxamide
CID 167856488

Frequently Asked Questions

What is the IUPAC name of N-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide?
The IUPAC name of N-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide (CID 146381550) is N-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide.
What is the SMILES notation for N-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide?
The canonical SMILES for N-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide is COc1nn(C)cc1C(=O)Nc1cccc(C(=O)NN)n1.
What is the InChIKey of N-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide?
The InChIKey is OCUBZXDIWOPORU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6O3/c1-18-6-7(12(17-18)21-2)10(19)15-9-5-3-4-8(14-9)11(20)16-13/h3-6H,13H2,1-2H3,(H,16,20)(H,14,15,19).
What are the key properties of N-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide?
N-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide has a molecular weight of 290.28 g/mol, XLogP of -0.32, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(hydrazinecarbonyl)-2-pyridinyl]-3-methoxy-1-methylpyrazole-4-carboxamide is sourced from PubChem (CID 146381550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).