5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine

C17H24N6S — CID 126918650

IUPAC5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine
SMILESCN(C)c1ncc(CNCC2CN(c3cc4c(nn3)CCC4)C2)s1
InChIInChI=1S/C17H24N6S/c1-22(2)17-19-9-14(24-17)8-18-7-12-10-23(11-12)16-6-13-4-3-5-15(13)20-21-16/h6,9,12,18H,3-5,7-8,10-11H2,1-2H3
InChIKeyKKWPLOBTLJSTAG-UHFFFAOYSA-N
MW344.49 g/mol
LogP1.71
Rot. Bonds6

About 5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine

5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine (PubChem CID 126918650) has the molecular formula C17H24N6S and a molecular weight of 344.49 g/mol. Its IUPAC name is 5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine
PubChem CID126918650
Molecular FormulaC17H24N6S
Molecular Weight344.49 g/mol
Exact Mass344.18
IUPAC Name5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine
SMILESCN(C)c1ncc(CNCC2CN(c3cc4c(nn3)CCC4)C2)s1
InChIInChI=1S/C17H24N6S/c1-22(2)17-19-9-14(24-17)8-18-7-12-10-23(11-12)16-6-13-4-3-5-15(13)20-21-16/h6,9,12,18H,3-5,7-8,10-11H2,1-2H3
InChIKeyKKWPLOBTLJSTAG-UHFFFAOYSA-N
XLogP1.71
TPSA57.18 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.49
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine with MolForge

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Related Compounds

N,N-dimethyl-5-[[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-1,3-thiazol-2-amine
CID 126916800
1-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N-(1,3-oxazol-5-ylmethyl)methanamine
CID 126918654
1-cyclopropyl-N-[[1-(5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]methanamine
CID 126919333
N-[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methyl]-5-methylpyrimidin-2-amine
CID 126918682
6-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-1,4-dioxepan-6-ol
CID 126918720
N-[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methyl]pyrazin-2-amine
CID 126918562
2-[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]-1-(1,3-thiazol-4-yl)ethanol
CID 126918709
2-[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]cyclopentan-1-ol
CID 126918719
N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N-methyl-6,7-dihydro-4H-pyrano[4,3-d][1,3]thiazol-2-amine
CID 126919127
2-[[1-(5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methylamino]cyclobutan-1-ol
CID 126919448
N-[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methyl]-2-methyl-1,3-oxazole-4-carboxamide
CID 126918547
1-[3-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-3-hydroxypiperidin-1-yl]ethanone
CID 126918712

Frequently Asked Questions

What is the IUPAC name of 5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine?
The IUPAC name of 5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine (CID 126918650) is 5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine is CN(C)c1ncc(CNCC2CN(c3cc4c(nn3)CCC4)C2)s1.
What is the InChIKey of 5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine?
The InChIKey is KKWPLOBTLJSTAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6S/c1-22(2)17-19-9-14(24-17)8-18-7-12-10-23(11-12)16-6-13-4-3-5-15(13)20-21-16/h6,9,12,18H,3-5,7-8,10-11H2,1-2H3.
What are the key properties of 5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine?
5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine has a molecular weight of 344.49 g/mol, XLogP of 1.71, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-N,N-dimethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 126918650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).