3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine

C14H14ClN7O — CID 58268960

IUPAC3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine
SMILESNc1nn2cccnc2c1-c1cc(Cl)nc(N2CCOCC2)n1
InChIInChI=1S/C14H14ClN7O/c15-10-8-9(18-14(19-10)21-4-6-23-7-5-21)11-12(16)20-22-3-1-2-17-13(11)22/h1-3,8H,4-7H2,(H2,16,20)
InChIKeyCZUIIOMNFBDJTB-UHFFFAOYSA-N
MW331.77 g/mol
LogP1.26
Rot. Bonds2

About 3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine

3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine (PubChem CID 58268960) has the molecular formula C14H14ClN7O and a molecular weight of 331.77 g/mol. Its IUPAC name is 3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine.

Molecular Properties

Compound Name3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine
PubChem CID58268960
Molecular FormulaC14H14ClN7O
Molecular Weight331.77 g/mol
Exact Mass331.09
IUPAC Name3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine
SMILESNc1nn2cccnc2c1-c1cc(Cl)nc(N2CCOCC2)n1
InChIInChI=1S/C14H14ClN7O/c15-10-8-9(18-14(19-10)21-4-6-23-7-5-21)11-12(16)20-22-3-1-2-17-13(11)22/h1-3,8H,4-7H2,(H2,16,20)
InChIKeyCZUIIOMNFBDJTB-UHFFFAOYSA-N
XLogP1.26
TPSA94.46 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.77
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

4-[4-chloro-6-(1H-imidazol-2-yl)pyrimidin-2-yl]morpholine
CID 87606474
3-(6-methylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine
CID 58268969
4-[4-chloro-6-(1,3-dimethylindazol-6-yl)pyrimidin-2-yl]morpholine
CID 121275852
1-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)cyclopropan-1-amine
CID 121428505
4-(difluoromethyl)-3-(2,6-dimorpholin-4-ylpyrimidin-4-yl)pyridin-2-amine
CID 172825051
4-(2,6-dichloro-4-pyridinyl)morpholine;2,4,6-trichloropyridine
CID 159726941
5-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyridin-2-amine;5-[6-(2-fluoro-3-pyridinyl)-2-morpholin-4-ylpyrimidin-4-yl]pyridin-2-amine;2-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
CID 161364270
1-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)piperidin-2-one
CID 59507587
5-(3,5-dichlorophenyl)-6-methyl-2-morpholin-4-ylpyrimidin-4-amine
CID 22360304
4-[4-chloro-6-(1-methylcyclopropyl)pyrimidin-2-yl]morpholine
CID 145100368
6-(2-aminopyrimidin-5-yl)-2-morpholin-4-yl-N-(1H-pyrazol-5-yl)pyrimidin-4-amine
CID 42613649
6-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)indazole-1-carboxylic acid
CID 121272415

Frequently Asked Questions

What is the IUPAC name of 3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine?
The IUPAC name of 3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine (CID 58268960) is 3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine.
What is the SMILES notation for 3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine?
The canonical SMILES for 3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine is Nc1nn2cccnc2c1-c1cc(Cl)nc(N2CCOCC2)n1.
What is the InChIKey of 3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine?
The InChIKey is CZUIIOMNFBDJTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN7O/c15-10-8-9(18-14(19-10)21-4-6-23-7-5-21)11-12(16)20-22-3-1-2-17-13(11)22/h1-3,8H,4-7H2,(H2,16,20).
What are the key properties of 3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine?
3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine has a molecular weight of 331.77 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-chloro-2-morpholin-4-ylpyrimidin-4-yl)pyrazolo[1,5-a]pyrimidin-2-amine is sourced from PubChem (CID 58268960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).