5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide

C14H17N5O2 — CID 107377812

IUPAC5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide
SMILESCOc1ccccc1CN(C)C(=O)c1cnc(NN)cn1
InChIInChI=1S/C14H17N5O2/c1-19(9-10-5-3-4-6-12(10)21-2)14(20)11-7-17-13(18-15)8-16-11/h3-8H,9,15H2,1-2H3,(H,17,18)
InChIKeyXMVABGVWSRMEST-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.04
Rot. Bonds5

About 5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide

5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide (PubChem CID 107377812) has the molecular formula C14H17N5O2 and a molecular weight of 287.32 g/mol. Its IUPAC name is 5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide
PubChem CID107377812
Molecular FormulaC14H17N5O2
Molecular Weight287.32 g/mol
Exact Mass287.14
IUPAC Name5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide
SMILESCOc1ccccc1CN(C)C(=O)c1cnc(NN)cn1
InChIInChI=1S/C14H17N5O2/c1-19(9-10-5-3-4-6-12(10)21-2)14(20)11-7-17-13(18-15)8-16-11/h3-8H,9,15H2,1-2H3,(H,17,18)
InChIKeyXMVABGVWSRMEST-UHFFFAOYSA-N
XLogP1.04
TPSA93.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

5-chloro-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide
CID 103803183
N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide
CID 31234095
6-amino-N-[(2-methoxyphenyl)methyl]-N-methylpyridine-2-carboxamide
CID 62239842
5-(ethylamino)-N-[(2-fluorophenyl)methyl]-N-methylpyrazine-2-carboxamide
CID 107375107
N-[(3-bromophenyl)methyl]-5-hydrazinyl-N-methylpyrazine-2-carboxamide
CID 107377870
5-amino-N-[(2-methoxyphenyl)methyl]-N,2-dimethylpyridine-3-carboxamide
CID 61112841
3-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylpyridine-2-carboxamide
CID 61417620
2,6-dihydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
CID 103748911
4-amino-N-[(2-methoxyphenyl)methyl]-N-methyl-1H-pyrazole-5-carboxamide
CID 63102134
N-[(2-chlorophenyl)methyl]-5-hydrazinyl-N-methylpyridine-2-carboxamide
CID 104642594
2-amino-5-bromo-N-[(2-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide
CID 62160081
N-[3-(dimethylamino)propyl]-5-[2-(2-methoxyphenyl)ethylamino]pyrazine-2-carboxamide
CID 109277760

Frequently Asked Questions

What is the IUPAC name of 5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide?
The IUPAC name of 5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide (CID 107377812) is 5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide is COc1ccccc1CN(C)C(=O)c1cnc(NN)cn1.
What is the InChIKey of 5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide?
The InChIKey is XMVABGVWSRMEST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O2/c1-19(9-10-5-3-4-6-12(10)21-2)14(20)11-7-17-13(18-15)8-16-11/h3-8H,9,15H2,1-2H3,(H,17,18).
What are the key properties of 5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide?
5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 1.04, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-[(2-methoxyphenyl)methyl]-N-methylpyrazine-2-carboxamide is sourced from PubChem (CID 107377812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).