[2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine

C16H17ClN6O — CID 70867227

IUPAC[2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine
SMILESNNc1cc(N2CCOCC2)n2nc(-c3cccc(Cl)c3)cc2n1
InChIInChI=1S/C16H17ClN6O/c17-12-3-1-2-11(8-12)13-9-15-19-14(20-18)10-16(23(15)21-13)22-4-6-24-7-5-22/h1-3,8-10H,4-7,18H2,(H,19,20)
InChIKeyYRIOXOLNXVDFNW-UHFFFAOYSA-N
MW344.81 g/mol
LogP2.17
Rot. Bonds3

About [2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine

[2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine (PubChem CID 70867227) has the molecular formula C16H17ClN6O and a molecular weight of 344.81 g/mol. Its IUPAC name is [2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine.

Molecular Properties

Compound Name[2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine
PubChem CID70867227
Molecular FormulaC16H17ClN6O
Molecular Weight344.81 g/mol
Exact Mass344.12
IUPAC Name[2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine
SMILESNNc1cc(N2CCOCC2)n2nc(-c3cccc(Cl)c3)cc2n1
InChIInChI=1S/C16H17ClN6O/c17-12-3-1-2-11(8-12)13-9-15-19-14(20-18)10-16(23(15)21-13)22-4-6-24-7-5-22/h1-3,8-10H,4-7,18H2,(H,19,20)
InChIKeyYRIOXOLNXVDFNW-UHFFFAOYSA-N
XLogP2.17
TPSA80.71 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.81
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2,7-dimorpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)hydrazine
CID 70999571
4-[(E)-[(7-morpholin-4-yl-2-phenylpyrazolo[1,5-a]pyrimidin-5-yl)hydrazinylidene]methyl]phenol
CID 136638182
N-[(E)-1H-indol-4-ylmethylideneamino]-7-morpholin-4-yl-2-phenylpyrazolo[1,5-a]pyrimidin-5-amine
CID 89176664
7-[4-(3-chlorophenyl)piperazin-1-yl]-5-methyl-2-phenylpyrazolo[1,5-a]pyrimidine
CID 4144309
7-morpholin-4-yl-2-phenyl-N-(3-phenylpropylideneamino)pyrazolo[1,5-a]pyrimidin-5-amine
CID 70999542
7-morpholin-4-yl-2-phenyl-N-[(E)-3-phenylpropylideneamino]pyrazolo[1,5-a]pyrimidin-5-amine
CID 70999540
2-(4-methylphenyl)-N-[(3-methylphenyl)methylideneamino]-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-amine
CID 76814775
2,5-bis(3-chlorophenyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 16641334
4-(5-chloro-2-quinolin-6-ylpyrazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 86659733
N-[(E)-(3-methylthiophen-2-yl)methylideneamino]-7-morpholin-4-yl-2-phenylpyrazolo[1,5-a]pyrimidin-5-amine
CID 89176627
N-[(E)-[(E)-2-methylpent-2-enylidene]amino]-7-morpholin-4-yl-2-phenylpyrazolo[1,5-a]pyrimidin-5-amine
CID 173488175
[2-(3-chlorophenyl)-5-propylpyrazolo[1,5-a]pyrimidin-7-yl]hydrazine
CID 82270367

Frequently Asked Questions

What is the IUPAC name of [2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine?
The IUPAC name of [2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine (CID 70867227) is [2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine.
What is the SMILES notation for [2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine?
The canonical SMILES for [2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine is NNc1cc(N2CCOCC2)n2nc(-c3cccc(Cl)c3)cc2n1.
What is the InChIKey of [2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine?
The InChIKey is YRIOXOLNXVDFNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN6O/c17-12-3-1-2-11(8-12)13-9-15-19-14(20-18)10-16(23(15)21-13)22-4-6-24-7-5-22/h1-3,8-10H,4-7,18H2,(H,19,20).
What are the key properties of [2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine?
[2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine has a molecular weight of 344.81 g/mol, XLogP of 2.17, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-chlorophenyl)-7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl]hydrazine is sourced from PubChem (CID 70867227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).