5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile

C15H13N5O — CID 1474968

IUPAC5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile
SMILESN#Cc1cnn2c1nc(N1CCOCC1)c1ccccc12
InChIInChI=1S/C15H13N5O/c16-9-11-10-17-20-13-4-2-1-3-12(13)15(18-14(11)20)19-5-7-21-8-6-19/h1-4,10H,5-8H2
InChIKeySWMVEKOZWMIKFL-UHFFFAOYSA-N
MW279.30 g/mol
LogP1.59
Rot. Bonds1

About 5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile

5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile (PubChem CID 1474968) has the molecular formula C15H13N5O and a molecular weight of 279.30 g/mol. Its IUPAC name is 5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile.

Molecular Properties

Compound Name5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile
PubChem CID1474968
Molecular FormulaC15H13N5O
Molecular Weight279.30 g/mol
Exact Mass279.11
IUPAC Name5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile
SMILESN#Cc1cnn2c1nc(N1CCOCC1)c1ccccc12
InChIInChI=1S/C15H13N5O/c16-9-11-10-17-20-13-4-2-1-3-12(13)15(18-14(11)20)19-5-7-21-8-6-19/h1-4,10H,5-8H2
InChIKeySWMVEKOZWMIKFL-UHFFFAOYSA-N
XLogP1.59
TPSA66.45 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-[4-(3-Quinolin-4-ylpyrazolo[1,5-a]pyrimidin-6-yl)phenyl]morpholine
CID 60182389
Pyrazolo pyrimidine, 5k
CID 25196900
Pyrazolo pyrimidine, 5l
CID 44520816
2-(Cyanomethyl)-7-phenylpyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 900932
4-(5,6-Dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 4912264
Pyrazolo[1,5-a]-1,3,5-triazine, 13-9
CID 42618215
Pyrazolo pyrimidine, 5i
CID 44520814
Pyrazolo pyrimidine, 5j
CID 44520815
5-(4-Fluorophenyl)-6-(2-morpholinoethyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
CID 1487690
4-(2-Methyl-3-phenyl-5-propylpyrazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 1850847
2-Benzyl-1,5-dimethyl-1,2,3,4-tetrahydropyrazolo[5',1':2,3]pyrimido[4,5-c]pyridazine-7-carbonitrile
CID 4563475
4-(5-Isopropyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)morpholine
CID 4870355

Frequently Asked Questions

What is the IUPAC name of 5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile?
The IUPAC name of 5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile (CID 1474968) is 5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile.
What is the SMILES notation for 5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile?
The canonical SMILES for 5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile is N#Cc1cnn2c1nc(N1CCOCC1)c1ccccc12.
What is the InChIKey of 5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile?
The InChIKey is SWMVEKOZWMIKFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5O/c16-9-11-10-17-20-13-4-2-1-3-12(13)15(18-14(11)20)19-5-7-21-8-6-19/h1-4,10H,5-8H2.
What are the key properties of 5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile?
5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile has a molecular weight of 279.30 g/mol, XLogP of 1.59, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-morpholin-4-ylpyrazolo[1,5-a]quinazoline-3-carbonitrile is sourced from PubChem (CID 1474968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).