N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine

C17H20N8S — CID 70989938

IUPACN-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine
SMILESCn1cc(C2CN=C3C(Nc4cc(C5CCNC5)ns4)=NC=CN32)cn1
InChIInChI=1S/C17H20N8S/c1-24-10-12(8-21-24)14-9-20-17-16(19-4-5-25(14)17)22-15-6-13(23-26-15)11-2-3-18-7-11/h4-6,8,10-11,14,18H,2-3,7,9H2,1H3,(H,19,22)
InChIKeyGSHCLOSZROVYHP-UHFFFAOYSA-N
MW368.47 g/mol
LogP1.70
Rot. Bonds3

About N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine

N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine (PubChem CID 70989938) has the molecular formula C17H20N8S and a molecular weight of 368.47 g/mol. Its IUPAC name is N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine.

Molecular Properties

Compound NameN-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine
PubChem CID70989938
Molecular FormulaC17H20N8S
Molecular Weight368.47 g/mol
Exact Mass368.15
IUPAC NameN-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine
SMILESCn1cc(C2CN=C3C(Nc4cc(C5CCNC5)ns4)=NC=CN32)cn1
InChIInChI=1S/C17H20N8S/c1-24-10-12(8-21-24)14-9-20-17-16(19-4-5-25(14)17)22-15-6-13(23-26-15)11-2-3-18-7-11/h4-6,8,10-11,14,18H,2-3,7,9H2,1H3,(H,19,22)
InChIKeyGSHCLOSZROVYHP-UHFFFAOYSA-N
XLogP1.70
TPSA82.73 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.47
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine?
The IUPAC name of N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine (CID 70989938) is N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine.
What is the SMILES notation for N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine?
The canonical SMILES for N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine is Cn1cc(C2CN=C3C(Nc4cc(C5CCNC5)ns4)=NC=CN32)cn1.
What is the InChIKey of N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine?
The InChIKey is GSHCLOSZROVYHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N8S/c1-24-10-12(8-21-24)14-9-20-17-16(19-4-5-25(14)17)22-15-6-13(23-26-15)11-2-3-18-7-11/h4-6,8,10-11,14,18H,2-3,7,9H2,1H3,(H,19,22).
What are the key properties of N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine?
N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine has a molecular weight of 368.47 g/mol, XLogP of 1.70, 3 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1-methylpyrazol-4-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-8-yl]-3-pyrrolidin-3-yl-1,2-thiazol-5-amine is sourced from PubChem (CID 70989938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).