3-amino-N,N,6-trimethylpyridazine-4-carboxamide

C8H12N4O — CID 153032042

IUPAC3-amino-N,N,6-trimethylpyridazine-4-carboxamide
SMILESCc1cc(C(=O)N(C)C)c(N)nn1
InChIInChI=1S/C8H12N4O/c1-5-4-6(7(9)11-10-5)8(13)12(2)3/h4H,1-3H3,(H2,9,11)
InChIKeyVDZNUBDYWDKJLN-UHFFFAOYSA-N
MW180.21 g/mol
LogP0.07
Rot. Bonds1

About 3-amino-N,N,6-trimethylpyridazine-4-carboxamide

3-amino-N,N,6-trimethylpyridazine-4-carboxamide (PubChem CID 153032042) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is 3-amino-N,N,6-trimethylpyridazine-4-carboxamide.

Molecular Properties

Compound Name3-amino-N,N,6-trimethylpyridazine-4-carboxamide
PubChem CID153032042
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC Name3-amino-N,N,6-trimethylpyridazine-4-carboxamide
SMILESCc1cc(C(=O)N(C)C)c(N)nn1
InChIInChI=1S/C8H12N4O/c1-5-4-6(7(9)11-10-5)8(13)12(2)3/h4H,1-3H3,(H2,9,11)
InChIKeyVDZNUBDYWDKJLN-UHFFFAOYSA-N
XLogP0.07
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-6-methylpyridazine-4-carboxamide
CID 6401352
N,N,6-trimethyl-3-(2-methyl-4,4-diphenylbut-3-en-2-yl)pyridazine-4-carboxamide
CID 171830576
N,3,6-trimethyl-N-[2-(methylamino)ethyl]pyridazine-4-carboxamide
CID 104671510
3-amino-2-hydroxy-N,N,4,5-tetramethylbenzamide
CID 130018685
6-amino-N,N,5-trimethylpyridine-3-carboxamide;ethane
CID 178150598
N,N,2-trimethyl-5-sulfanylbenzamide
CID 107021651
N-(1-hydroxy-2-methylpropan-2-yl)-N,3,6-trimethylpyridazine-4-carboxamide
CID 113476040
3-ethyl-N-(2-hydroxyethyl)-N,6-dimethylpyridazine-4-carboxamide
CID 104625488
N-[(2-aminophenyl)methyl]-3-ethyl-N,6-dimethylpyridazine-4-carboxamide
CID 104669113
N-(2-bromoethyl)-3-ethyl-N,6-dimethylpyridazine-4-carboxamide
CID 104672507
2-amino-4-bromo-N,N-dimethylbenzamide
CID 79714600
4-amino-N,N-dimethylpyridine-2-carboxamide;hydrochloride
CID 167725414

Frequently Asked Questions

What is the IUPAC name of 3-amino-N,N,6-trimethylpyridazine-4-carboxamide?
The IUPAC name of 3-amino-N,N,6-trimethylpyridazine-4-carboxamide (CID 153032042) is 3-amino-N,N,6-trimethylpyridazine-4-carboxamide.
What is the SMILES notation for 3-amino-N,N,6-trimethylpyridazine-4-carboxamide?
The canonical SMILES for 3-amino-N,N,6-trimethylpyridazine-4-carboxamide is Cc1cc(C(=O)N(C)C)c(N)nn1.
What is the InChIKey of 3-amino-N,N,6-trimethylpyridazine-4-carboxamide?
The InChIKey is VDZNUBDYWDKJLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c1-5-4-6(7(9)11-10-5)8(13)12(2)3/h4H,1-3H3,(H2,9,11).
What are the key properties of 3-amino-N,N,6-trimethylpyridazine-4-carboxamide?
3-amino-N,N,6-trimethylpyridazine-4-carboxamide has a molecular weight of 180.21 g/mol, XLogP of 0.07, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N,N,6-trimethylpyridazine-4-carboxamide is sourced from PubChem (CID 153032042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).