N-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine

C19H20N6OS — CID 24822505

IUPACN-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine
SMILESCc1cc(Nc2cc(C3CCCNC3)nc3c(-c4ccoc4)cnn23)sn1
InChIInChI=1S/C19H20N6OS/c1-12-7-18(27-24-12)23-17-8-16(13-3-2-5-20-9-13)22-19-15(10-21-25(17)19)14-4-6-26-11-14/h4,6-8,10-11,13,20,23H,2-3,5,9H2,1H3
InChIKeyHCKIKZCKUZSLHJ-UHFFFAOYSA-N
MW380.48 g/mol
LogP3.96
Rot. Bonds4

About N-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine

N-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine (PubChem CID 24822505) has the molecular formula C19H20N6OS and a molecular weight of 380.48 g/mol. Its IUPAC name is N-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine.

Molecular Properties

Compound NameN-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine
PubChem CID24822505
Molecular FormulaC19H20N6OS
Molecular Weight380.48 g/mol
Exact Mass380.14
IUPAC NameN-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine
SMILESCc1cc(Nc2cc(C3CCCNC3)nc3c(-c4ccoc4)cnn23)sn1
InChIInChI=1S/C19H20N6OS/c1-12-7-18(27-24-12)23-17-8-16(13-3-2-5-20-9-13)22-19-15(10-21-25(17)19)14-4-6-26-11-14/h4,6-8,10-11,13,20,23H,2-3,5,9H2,1H3
InChIKeyHCKIKZCKUZSLHJ-UHFFFAOYSA-N
XLogP3.96
TPSA80.28 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.48
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze N-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine?
The IUPAC name of N-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine (CID 24822505) is N-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine.
What is the SMILES notation for N-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine?
The canonical SMILES for N-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine is Cc1cc(Nc2cc(C3CCCNC3)nc3c(-c4ccoc4)cnn23)sn1.
What is the InChIKey of N-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine?
The InChIKey is HCKIKZCKUZSLHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6OS/c1-12-7-18(27-24-12)23-17-8-16(13-3-2-5-20-9-13)22-19-15(10-21-25(17)19)14-4-6-26-11-14/h4,6-8,10-11,13,20,23H,2-3,5,9H2,1H3.
What are the key properties of N-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine?
N-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine has a molecular weight of 380.48 g/mol, XLogP of 3.96, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-3-yl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-yl]-3-methyl-1,2-thiazol-5-amine is sourced from PubChem (CID 24822505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).