5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine

C9H11ClN4 — CID 23131907

IUPAC5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCCNc1cc(Cl)nc2ccnn12
InChIInChI=1S/C9H11ClN4/c1-2-4-11-9-6-7(10)13-8-3-5-12-14(8)9/h3,5-6,11H,2,4H2,1H3
InChIKeyDHURWERNSHKAGS-UHFFFAOYSA-N
MW210.67 g/mol
LogP2.20
Rot. Bonds3

About 5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine

5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 23131907) has the molecular formula C9H11ClN4 and a molecular weight of 210.67 g/mol. Its IUPAC name is 5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID23131907
Molecular FormulaC9H11ClN4
Molecular Weight210.67 g/mol
Exact Mass210.07
IUPAC Name5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCCNc1cc(Cl)nc2ccnn12
InChIInChI=1S/C9H11ClN4/c1-2-4-11-9-6-7(10)13-8-3-5-12-14(8)9/h3,5-6,11H,2,4H2,1H3
InChIKeyDHURWERNSHKAGS-UHFFFAOYSA-N
XLogP2.20
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.67
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(4-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 58938401
5-chloro-N-(2-morpholin-4-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 86654661
5-chloro-N-(3-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 11460143
5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 56890779
5-[(5-chloropyrazolo[1,5-a]pyrimidin-7-yl)amino]-3-(3-hydroxy-3-methylbutyl)-1-methylbenzimidazol-2-one
CID 135386207
5-ethyl-N-(4-pyrrolidin-1-ylbutyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 56914218
5-propan-2-yl-N-(2-pyridin-4-ylethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 70715488
6-chloro-2-methyl-N-propylpyrimidin-4-amine
CID 11074100
tert-butyl 3-[(5-chloropyrazolo[1,5-a]pyrimidin-7-yl)amino]benzoate;5,7-dichloropyrazolo[1,5-a]pyrimidine
CID 159108788
(2S)-N-[2-[(5-chloropyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]-4-fluoro-4-methyl-2-[[(1S)-2,2,2-trifluoro-1-[4-(4-methylsulfonylphenyl)phenyl]ethyl]amino]pentanamide
CID 143879235
4-methoxy-N-[2-[(5-methylpyrazolo[1,5-a]pyrimidin-7-yl)amino]ethyl]benzenesulfonamide
CID 56888706
5-ethyl-N-[2-(4-fluorophenyl)sulfonylethyl]pyrazolo[1,5-a]pyrimidin-7-amine
CID 56890412

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine (CID 23131907) is 5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine is CCCNc1cc(Cl)nc2ccnn12.
What is the InChIKey of 5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is DHURWERNSHKAGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN4/c1-2-4-11-9-6-7(10)13-8-3-5-12-14(8)9/h3,5-6,11H,2,4H2,1H3.
What are the key properties of 5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine?
5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 210.67 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-propylpyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 23131907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).