6-butyl-N,4,5-trimethylpyridazin-3-amine

C11H19N3 — CID 106659403

IUPAC6-butyl-N,4,5-trimethylpyridazin-3-amine
SMILESCCCCc1nnc(NC)c(C)c1C
InChIInChI=1S/C11H19N3/c1-5-6-7-10-8(2)9(3)11(12-4)14-13-10/h5-7H2,1-4H3,(H,12,14)
InChIKeyJPNJQSHMCQTSAI-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.48
Rot. Bonds4

About 6-butyl-N,4,5-trimethylpyridazin-3-amine

6-butyl-N,4,5-trimethylpyridazin-3-amine (PubChem CID 106659403) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 6-butyl-N,4,5-trimethylpyridazin-3-amine.

Molecular Properties

Compound Name6-butyl-N,4,5-trimethylpyridazin-3-amine
PubChem CID106659403
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name6-butyl-N,4,5-trimethylpyridazin-3-amine
SMILESCCCCc1nnc(NC)c(C)c1C
InChIInChI=1S/C11H19N3/c1-5-6-7-10-8(2)9(3)11(12-4)14-13-10/h5-7H2,1-4H3,(H,12,14)
InChIKeyJPNJQSHMCQTSAI-UHFFFAOYSA-N
XLogP2.48
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-butyl-N-ethyl-4,5-dimethylpyridazin-3-amine
CID 106659331
6-chloro-N,4,5-trimethylpyridazin-3-amine
CID 63271800
N-(4-butylphthalazin-1-yl)hydroxylamine
CID 136951511
N,4,5-trimethyl-6-(3-propylphenyl)pyridazin-3-amine
CID 116546128
4-butyl-3,6-dichloro-5-methylpyridazine
CID 164864335
2-butyl-5-ethyl-N,6-dimethylpyrimidin-4-amine
CID 79412709
3-butyl-N-ethyl-5,6-dimethylpyrazin-2-amine
CID 106659375
1,3,5-tributyl-2,4,6-trimethylbenzene
CID 123628431
4,5-dibutyl-2H-triazole
CID 54195681
1,2,3,4,5,6-hexabutylbenzene
CID 12586860
4-N-(4-butylphenyl)-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80779469
2-N,8-dibutyl-6-N-ethyl-4-N-methylpyrimido[5,4-d]pyrimidine-2,4,6-triamine
CID 148836551

Frequently Asked Questions

What is the IUPAC name of 6-butyl-N,4,5-trimethylpyridazin-3-amine?
The IUPAC name of 6-butyl-N,4,5-trimethylpyridazin-3-amine (CID 106659403) is 6-butyl-N,4,5-trimethylpyridazin-3-amine.
What is the SMILES notation for 6-butyl-N,4,5-trimethylpyridazin-3-amine?
The canonical SMILES for 6-butyl-N,4,5-trimethylpyridazin-3-amine is CCCCc1nnc(NC)c(C)c1C.
What is the InChIKey of 6-butyl-N,4,5-trimethylpyridazin-3-amine?
The InChIKey is JPNJQSHMCQTSAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-5-6-7-10-8(2)9(3)11(12-4)14-13-10/h5-7H2,1-4H3,(H,12,14).
What are the key properties of 6-butyl-N,4,5-trimethylpyridazin-3-amine?
6-butyl-N,4,5-trimethylpyridazin-3-amine has a molecular weight of 193.29 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-butyl-N,4,5-trimethylpyridazin-3-amine is sourced from PubChem (CID 106659403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).