7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine

C15H13Cl2N3 — CID 82269954

IUPAC7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine
SMILESCCCc1cc(Cl)n2nc(-c3cccc(Cl)c3)cc2n1
InChIInChI=1S/C15H13Cl2N3/c1-2-4-12-8-14(17)20-15(18-12)9-13(19-20)10-5-3-6-11(16)7-10/h3,5-9H,2,4H2,1H3
InChIKeyMXVUARPGYFPMCD-UHFFFAOYSA-N
MW306.20 g/mol
LogP4.66
Rot. Bonds3

About 7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine

7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine (PubChem CID 82269954) has the molecular formula C15H13Cl2N3 and a molecular weight of 306.20 g/mol. Its IUPAC name is 7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine
PubChem CID82269954
Molecular FormulaC15H13Cl2N3
Molecular Weight306.20 g/mol
Exact Mass305.05
IUPAC Name7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine
SMILESCCCc1cc(Cl)n2nc(-c3cccc(Cl)c3)cc2n1
InChIInChI=1S/C15H13Cl2N3/c1-2-4-12-8-14(17)20-15(18-12)9-13(19-20)10-5-3-6-11(16)7-10/h3,5-9H,2,4H2,1H3
InChIKeyMXVUARPGYFPMCD-UHFFFAOYSA-N
XLogP4.66
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.20
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

7-chloro-2-(3-methoxyphenyl)-5-propylpyrazolo[1,5-a]pyrimidine
CID 82269959
[2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidin-7-yl]hydrazine
CID 82270367
7-chloro-2-(4-methylphenyl)-5-propylpyrazolo[1,5-a]pyrimidine
CID 82269952
2-[7-chloro-2-(3-methylphenyl)pyrazolo[1,5-a]pyrimidin-5-yl]acetic acid
CID 82271664
2,5-bis(3-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 16641334
7-chloro-5-ethyl-2-(4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine
CID 82269989
2-(7-chloro-2-phenylpyrazolo[1,5-a]pyrimidin-5-yl)acetic acid
CID 82271662
7-chloro-2-cyclobutyl-5-propylpyrazolo[1,5-a]pyrimidine
CID 82269944
7-chloro-5-ethyl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine
CID 82269997
3-[[2-(3-chlorophenyl)-5,6-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]amino]propyl-diethylazanium
CID 7440565
4,6-dichloro-5-(3-chlorophenyl)-2-propylpyrimidine
CID 79441111
7-chloro-5-methyl-2-propylpyrazolo[1,5-a]pyrimidine
CID 83702760

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine?
The IUPAC name of 7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine (CID 82269954) is 7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine is CCCc1cc(Cl)n2nc(-c3cccc(Cl)c3)cc2n1.
What is the InChIKey of 7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine?
The InChIKey is MXVUARPGYFPMCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2N3/c1-2-4-12-8-14(17)20-15(18-12)9-13(19-20)10-5-3-6-11(16)7-10/h3,5-9H,2,4H2,1H3.
What are the key properties of 7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine?
7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine has a molecular weight of 306.20 g/mol, XLogP of 4.66, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 82269954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).