6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine

C11H15ClF3N3 — CID 63271601

IUPAC6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine
SMILESCCCN(CC(F)(F)F)c1nnc(Cl)c(C)c1C
InChIInChI=1S/C11H15ClF3N3/c1-4-5-18(6-11(13,14)15)10-8(3)7(2)9(12)16-17-10/h4-6H2,1-3H3
InChIKeyZKYYQGCRIWFQHM-UHFFFAOYSA-N
MW281.71 g/mol
LogP3.53
Rot. Bonds4

About 6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine

6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine (PubChem CID 63271601) has the molecular formula C11H15ClF3N3 and a molecular weight of 281.71 g/mol. Its IUPAC name is 6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine
PubChem CID63271601
Molecular FormulaC11H15ClF3N3
Molecular Weight281.71 g/mol
Exact Mass281.09
IUPAC Name6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine
SMILESCCCN(CC(F)(F)F)c1nnc(Cl)c(C)c1C
InChIInChI=1S/C11H15ClF3N3/c1-4-5-18(6-11(13,14)15)10-8(3)7(2)9(12)16-17-10/h4-6H2,1-3H3
InChIKeyZKYYQGCRIWFQHM-UHFFFAOYSA-N
XLogP3.53
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.71
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-N-ethyl-4,5-dimethyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine
CID 55169868
6-chloro-N-cyclopropyl-4,5-dimethyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine
CID 55169869
6-chloro-N-ethyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine
CID 61607329
6-chloro-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine
CID 61607588
6-chloro-4,5-dimethyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine
CID 63271501
6-chloro-N,4,5-trimethyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine
CID 63271550
6-chloro-4,5-dimethyl-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine
CID 63271640
6-chloro-4,5-dimethyl-N-(3,3,3-trifluoropropyl)pyridazin-3-amine
CID 63272307
3-Chloro-4,5-dimethyl-6-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]pyridazine
CID 63272440
6-chloro-N-methyl-N-(3,3,3-trifluoropropyl)pyridazin-3-amine
CID 65530810
6-chloro-N,4,5-trimethyl-N-(3,3,3-trifluoropropyl)pyridazin-3-amine
CID 65531582
3-Chloro-4,5-dimethyl-6-[3-(trifluoromethyl)piperidin-1-yl]pyridazine
CID 65531784

Frequently Asked Questions

What is the IUPAC name of 6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine?
The IUPAC name of 6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine (CID 63271601) is 6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine.
What is the SMILES notation for 6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine?
The canonical SMILES for 6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine is CCCN(CC(F)(F)F)c1nnc(Cl)c(C)c1C.
What is the InChIKey of 6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine?
The InChIKey is ZKYYQGCRIWFQHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClF3N3/c1-4-5-18(6-11(13,14)15)10-8(3)7(2)9(12)16-17-10/h4-6H2,1-3H3.
What are the key properties of 6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine?
6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine has a molecular weight of 281.71 g/mol, XLogP of 3.53, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4,5-dimethyl-N-propyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine is sourced from PubChem (CID 63271601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).