N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine

C11H11N5S — CID 113296727

IUPACN-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine
SMILESCC(Nc1ccn2nccc2n1)c1nccs1
InChIInChI=1S/C11H11N5S/c1-8(11-12-5-7-17-11)14-9-3-6-16-10(15-9)2-4-13-16/h2-8H,1H3,(H,14,15)
InChIKeyKFVCPQOATMGOOK-UHFFFAOYSA-N
MW245.31 g/mol
LogP2.36
Rot. Bonds3

About N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine

N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine (PubChem CID 113296727) has the molecular formula C11H11N5S and a molecular weight of 245.31 g/mol. Its IUPAC name is N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine.

Molecular Properties

Compound NameN-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine
PubChem CID113296727
Molecular FormulaC11H11N5S
Molecular Weight245.31 g/mol
Exact Mass245.07
IUPAC NameN-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine
SMILESCC(Nc1ccn2nccc2n1)c1nccs1
InChIInChI=1S/C11H11N5S/c1-8(11-12-5-7-17-11)14-9-3-6-16-10(15-9)2-4-13-16/h2-8H,1H3,(H,14,15)
InChIKeyKFVCPQOATMGOOK-UHFFFAOYSA-N
XLogP2.36
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.31
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-[2-(2,2-difluoroethoxy)phenyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 164786297
6-[1-(1,3-thiazol-2-yl)ethylamino]pyridine-2-carbothioamide
CID 64593735
6-hydrazinyl-2-methyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
CID 80917620
N-[(3-methylthiophen-2-yl)methyl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 115372644
N-[1-[5-fluoro-2-(2-fluoroethoxy)phenyl]ethyl]pyrazolo[1,5-a]pyrimidin-5-amine
CID 155668392
N-[1-(1,3-thiazol-2-yl)ethyl]-1,3-thiazol-2-amine
CID 63612751
6-hydrazinyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrazin-2-amine
CID 80917852
2,5-dimethyl-N-[1-(1,3-thiazol-2-yl)ethyl]pyrrol-1-amine
CID 79091110
4-phenyl-N-[1-(1,3-thiazol-2-yl)ethyl]aniline
CID 64993028
6-N-methyl-4-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidine-4,6-diamine
CID 80844662
2-fluoro-N-[(1S)-1-(1,3-thiazol-2-yl)ethyl]aniline
CID 96824348
2-(pyrazolo[1,5-a]pyrimidin-5-ylamino)pentanoic acid
CID 115372015

Frequently Asked Questions

What is the IUPAC name of N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine?
The IUPAC name of N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine (CID 113296727) is N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine.
What is the SMILES notation for N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine?
The canonical SMILES for N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine is CC(Nc1ccn2nccc2n1)c1nccs1.
What is the InChIKey of N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine?
The InChIKey is KFVCPQOATMGOOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5S/c1-8(11-12-5-7-17-11)14-9-3-6-16-10(15-9)2-4-13-16/h2-8H,1H3,(H,14,15).
What are the key properties of N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine?
N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine has a molecular weight of 245.31 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1,3-thiazol-2-yl)ethyl]pyrazolo[1,5-a]pyrimidin-5-amine is sourced from PubChem (CID 113296727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).