6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine

C12H20ClN3O — CID 81061968

IUPAC6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine
SMILESCc1c(Cl)nnc(N(C)CCOC(C)C)c1C
InChIInChI=1S/C12H20ClN3O/c1-8(2)17-7-6-16(5)12-10(4)9(3)11(13)14-15-12/h8H,6-7H2,1-5H3
InChIKeyLITWSOKTHJTLKV-UHFFFAOYSA-N
MW257.76 g/mol
LogP2.61
Rot. Bonds5

About 6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine

6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine (PubChem CID 81061968) has the molecular formula C12H20ClN3O and a molecular weight of 257.76 g/mol. Its IUPAC name is 6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine
PubChem CID81061968
Molecular FormulaC12H20ClN3O
Molecular Weight257.76 g/mol
Exact Mass257.13
IUPAC Name6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine
SMILESCc1c(Cl)nnc(N(C)CCOC(C)C)c1C
InChIInChI=1S/C12H20ClN3O/c1-8(2)17-7-6-16(5)12-10(4)9(3)11(13)14-15-12/h8H,6-7H2,1-5H3
InChIKeyLITWSOKTHJTLKV-UHFFFAOYSA-N
XLogP2.61
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.76
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine
CID 81062603
2-tert-butyl-6-chloro-N,5-dimethyl-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine
CID 81061593
5-[(6-chloro-4,5-dimethylpyridazin-3-yl)-methylamino]pentan-1-ol
CID 107201841
5,6-dimethyl-3-[methyl(2-propan-2-yloxyethyl)amino]pyridazine-4-carboxylic acid
CID 81074322
6-chloro-4-N-methyl-4-N-(2-propan-2-yloxyethyl)pyrimidine-4,5-diamine
CID 81059374
4-N,6-N,2,5-tetramethyl-4-N-(2-propan-2-yloxyethyl)pyrimidine-4,6-diamine
CID 81067453
4-N,6-N,5-trimethyl-4-N-(2-propan-2-yloxyethyl)pyrimidine-4,6-diamine
CID 81068634
4-N,5-dimethyl-2-propan-2-yl-4-N-(2-propan-2-yloxyethyl)pyrimidine-4,6-diamine
CID 81068833
3-N-methyl-3-N-(2-propan-2-yloxyethyl)pyrazine-2,3-diamine
CID 103768529
N-[(4-bromophenyl)methyl]-6-chloro-N,4,5-trimethylpyridazin-3-amine
CID 63272064
6-chloro-N-[(2-methoxyphenyl)methyl]-N,4,5-trimethylpyridazin-3-amine
CID 63271464
6-chloro-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine
CID 63271589

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine?
The IUPAC name of 6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine (CID 81061968) is 6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine.
What is the SMILES notation for 6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine?
The canonical SMILES for 6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine is Cc1c(Cl)nnc(N(C)CCOC(C)C)c1C.
What is the InChIKey of 6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine?
The InChIKey is LITWSOKTHJTLKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20ClN3O/c1-8(2)17-7-6-16(5)12-10(4)9(3)11(13)14-15-12/h8H,6-7H2,1-5H3.
What are the key properties of 6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine?
6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine has a molecular weight of 257.76 g/mol, XLogP of 2.61, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine is sourced from PubChem (CID 81061968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).