5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine

C13H18N6S — CID 56910684

IUPAC5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine
SMILESNc1nc2c(s1)CN(Cc1cc3n(n1)CCNC3)CC2
InChIInChI=1S/C13H18N6S/c14-13-16-11-1-3-18(8-12(11)20-13)7-9-5-10-6-15-2-4-19(10)17-9/h5,15H,1-4,6-8H2,(H2,14,16)
InChIKeyRCNGBQFRBKDCTQ-UHFFFAOYSA-N
MW290.40 g/mol
LogP0.58
Rot. Bonds2

About 5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine

5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine (PubChem CID 56910684) has the molecular formula C13H18N6S and a molecular weight of 290.40 g/mol. Its IUPAC name is 5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine.

Molecular Properties

Compound Name5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine
PubChem CID56910684
Molecular FormulaC13H18N6S
Molecular Weight290.40 g/mol
Exact Mass290.13
IUPAC Name5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine
SMILESNc1nc2c(s1)CN(Cc1cc3n(n1)CCNC3)CC2
InChIInChI=1S/C13H18N6S/c14-13-16-11-1-3-18(8-12(11)20-13)7-9-5-10-6-15-2-4-19(10)17-9/h5,15H,1-4,6-8H2,(H2,14,16)
InChIKeyRCNGBQFRBKDCTQ-UHFFFAOYSA-N
XLogP0.58
TPSA72.00 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.40
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-({4-[(2-Methyl-1,3-thiazol-4-yl)methyl]-1-piperazinyl}methyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine dihydrochloride
CID 56885364
2-{[4-(1,3-Thiazol-2-yl)-1-piperazinyl]methyl}-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
CID 56917819
5-(5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-2-ylmethyl)-4,5,6,7-tetrahydro[1,3]thiazolo[5,4-c]pyridin-2-amine dihydrochloride
CID 56912686
4-[(3,5-Dimethylpyrazol-1-yl)methyl]-1,3-thiazol-2-amine
CID 43137963
2-(3,5-dimethylpyrazol-1-yl)-N-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
CID 43648254
2-(3,5-dimethylpyrazol-1-yl)-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
CID 45799151
2-({methyl[2-(4-methyl-1,3-thiazol-5-yl)ethyl]amino}methyl)-N-propyl-6,7-dihydropyrazolo[1,5-a]pyrazine-5(4H)-carboxamide
CID 56902280
4-[(3,5-Diethylpyrazol-1-yl)methyl]-1,3-thiazol-2-amine
CID 82695177
4-{[[3-(3,5-dimethyl-1H-pyrazol-1-yl)propyl](methyl)amino]methyl}-N-methyl-1,3-thiazol-2-amine
CID 91829188
5-[(2-Ethyl-1,3-thiazol-4-yl)methyl]-2-methyl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
CID 91830397
4-{[[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethyl](methyl)amino]methyl}-N-methyl-1,3-thiazol-2-amine
CID 91843152
4-Methyl-2-(3-methyl-4,5,6,7-tetrahydropyrazolo[3,4-c]pyridin-2-yl)-1,3-thiazole
CID 96596564

Frequently Asked Questions

What is the IUPAC name of 5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The IUPAC name of 5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine (CID 56910684) is 5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine.
What is the SMILES notation for 5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The canonical SMILES for 5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine is Nc1nc2c(s1)CN(Cc1cc3n(n1)CCNC3)CC2.
What is the InChIKey of 5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The InChIKey is RCNGBQFRBKDCTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N6S/c14-13-16-11-1-3-18(8-12(11)20-13)7-9-5-10-6-15-2-4-19(10)17-9/h5,15H,1-4,6-8H2,(H2,14,16).
What are the key properties of 5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine has a molecular weight of 290.40 g/mol, XLogP of 0.58, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-2-ylmethyl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine is sourced from PubChem (CID 56910684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).