N-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide

C10H15N3O2 — CID 118545198

IUPACN-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide
SMILESCc1ccc(C(=O)NCC(C)(C)O)nn1
InChIInChI=1S/C10H15N3O2/c1-7-4-5-8(13-12-7)9(14)11-6-10(2,3)15/h4-5,15H,6H2,1-3H3,(H,11,14)
InChIKeySAJAGXVBAQPXBM-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.29
Rot. Bonds3

About N-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide

N-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide (PubChem CID 118545198) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is N-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide
PubChem CID118545198
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC NameN-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide
SMILESCc1ccc(C(=O)NCC(C)(C)O)nn1
InChIInChI=1S/C10H15N3O2/c1-7-4-5-8(13-12-7)9(14)11-6-10(2,3)15/h4-5,15H,6H2,1-3H3,(H,11,14)
InChIKeySAJAGXVBAQPXBM-UHFFFAOYSA-N
XLogP0.29
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-N-propylpyridazine-3-carboxamide
CID 110705181
N-[(2S)-2-hydroxypropyl]-6-methylpyridazine-3-carboxamide
CID 131169237
2-[[(6-methylpyridazine-3-carbonyl)amino]methyl]-2-phenylbutanoic acid
CID 138054881
N-[3-(dimethylamino)propyl]-6-methylpyridazine-3-carboxamide
CID 110705198
N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide
CID 65109884
N-(3-amino-2,2-dimethyl-3-oxopropyl)-6-chloropyridazine-3-carboxamide
CID 106276043
6-chloro-N-(4-hydroxy-2,2-dimethylbutyl)pyridazine-3-carboxamide
CID 106140440
N-[2-(4-methoxyphenyl)ethyl]-6-methylpyridazine-3-carboxamide
CID 110705227
N-[(2R)-2-hydroxy-2-methyl-3-methylsulfanylpropyl]-6-methylpyridine-2-carboxamide
CID 95773940
6-methyl-N-(3,3,3-trifluoro-2-hydroxy-2-methylpropyl)pyridine-2-carboxamide
CID 136518357
N-(4-ethylphenyl)-6-methylpyridazine-3-carboxamide
CID 110705292
N-[2-(2-methoxyphenyl)ethyl]-6-methylpyridazine-3-carboxamide
CID 110705225

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide?
The IUPAC name of N-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide (CID 118545198) is N-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide?
The canonical SMILES for N-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide is Cc1ccc(C(=O)NCC(C)(C)O)nn1.
What is the InChIKey of N-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide?
The InChIKey is SAJAGXVBAQPXBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-7-4-5-8(13-12-7)9(14)11-6-10(2,3)15/h4-5,15H,6H2,1-3H3,(H,11,14).
What are the key properties of N-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide?
N-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide has a molecular weight of 209.25 g/mol, XLogP of 0.29, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide is sourced from PubChem (CID 118545198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).