3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine

C15H19ClN4 — CID 152595459

IUPAC3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine
SMILESCc1cn2nc(C3CCCCN3)c(Cl)c2nc1C1CC1
InChIInChI=1S/C15H19ClN4/c1-9-8-20-15(18-13(9)10-5-6-10)12(16)14(19-20)11-4-2-3-7-17-11/h8,10-11,17H,2-7H2,1H3
InChIKeyYWJMPPINFWQGMB-UHFFFAOYSA-N
MW290.80 g/mol
LogP3.38
Rot. Bonds2

About 3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine

3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine (PubChem CID 152595459) has the molecular formula C15H19ClN4 and a molecular weight of 290.80 g/mol. Its IUPAC name is 3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine
PubChem CID152595459
Molecular FormulaC15H19ClN4
Molecular Weight290.80 g/mol
Exact Mass290.13
IUPAC Name3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine
SMILESCc1cn2nc(C3CCCCN3)c(Cl)c2nc1C1CC1
InChIInChI=1S/C15H19ClN4/c1-9-8-20-15(18-13(9)10-5-6-10)12(16)14(19-20)11-4-2-3-7-17-11/h8,10-11,17H,2-7H2,1H3
InChIKeyYWJMPPINFWQGMB-UHFFFAOYSA-N
XLogP3.38
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.80
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-cyclopropyl-1-methyl-4-pyrrolidin-2-ylpyrazole
CID 83829953
3,8-dimethyl-2-piperidin-2-ylimidazo[1,2-a]pyridine
CID 115037395
5-chloro-7-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine
CID 76668404
(2S)-2-(2-chloro-3-methylphenyl)pyrrolidine
CID 55274966
2-chloro-4-methyl-5-piperidin-2-ylpyrimidine
CID 115070172
3-chloro-2-piperidin-2-ylimidazo[1,2-a]pyridine
CID 84699125
2-chloro-4,6-dimethyl-5-piperidin-2-ylpyrimidine
CID 115070130
2-(4-methyl-1,2,4-triazol-3-yl)piperidine
CID 62406028
2,5-dimethyl-4-piperidin-2-yl-1,3-thiazole
CID 82399301
2-(3-methyl-2-pyridinyl)azepane
CID 81148387
5-methyl-7-[(2R)-piperidin-2-yl]imidazo[5,1-b][1,3]thiazole
CID 125005086
2-(5-bromo-4-chloro-2-methylphenyl)piperidine
CID 84814511

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine (CID 152595459) is 3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine is Cc1cn2nc(C3CCCCN3)c(Cl)c2nc1C1CC1.
What is the InChIKey of 3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine?
The InChIKey is YWJMPPINFWQGMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN4/c1-9-8-20-15(18-13(9)10-5-6-10)12(16)14(19-20)11-4-2-3-7-17-11/h8,10-11,17H,2-7H2,1H3.
What are the key properties of 3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine?
3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine has a molecular weight of 290.80 g/mol, XLogP of 3.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-cyclopropyl-6-methyl-2-piperidin-2-ylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 152595459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).