4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine

C14H14BrN5O2 — CID 133347170

IUPAC4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine
SMILESCn1nc(Br)c2c(N3CCOC(c4ccco4)C3)ncnc21
InChIInChI=1S/C14H14BrN5O2/c1-19-13-11(12(15)18-19)14(17-8-16-13)20-4-6-22-10(7-20)9-3-2-5-21-9/h2-3,5,8,10H,4,6-7H2,1H3
InChIKeyGSCYZMBKZHUCRX-UHFFFAOYSA-N
MW364.20 g/mol
LogP2.30
Rot. Bonds2

About 4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine

4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine (PubChem CID 133347170) has the molecular formula C14H14BrN5O2 and a molecular weight of 364.20 g/mol. Its IUPAC name is 4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine.

Molecular Properties

Compound Name4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine
PubChem CID133347170
Molecular FormulaC14H14BrN5O2
Molecular Weight364.20 g/mol
Exact Mass363.03
IUPAC Name4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine
SMILESCn1nc(Br)c2c(N3CCOC(c4ccco4)C3)ncnc21
InChIInChI=1S/C14H14BrN5O2/c1-19-13-11(12(15)18-19)14(17-8-16-13)20-4-6-22-10(7-20)9-3-2-5-21-9/h2-3,5,8,10H,4,6-7H2,1H3
InChIKeyGSCYZMBKZHUCRX-UHFFFAOYSA-N
XLogP2.30
TPSA69.21 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.20
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(4-benzyl-3-propylpiperazin-1-yl)-3-bromo-1-methylpyrazolo[5,4-d]pyrimidine
CID 133435764
3-bromo-1-methyl-4-[4-(3-methylbutyl)piperidin-1-yl]pyrazolo[5,4-d]pyrimidine
CID 133380766
2-[1-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)piperidin-3-yl]oxyethanol
CID 133315305
2-(furan-2-yl)-4-(6-methylsulfanylpyridazin-3-yl)morpholine
CID 133347260
2-(4-chlorophenyl)-4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine
CID 86808286
(2S)-2-(4-fluorophenyl)-4-(1-methylpyrazolo[5,4-d]pyrimidin-4-yl)morpholine
CID 36726848
2-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-6-fluoro-3,4-dihydro-1H-isoquinoline
CID 133422516
tert-butyl (2R)-4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-methylpiperazine-1-carboxylate
CID 133499530
2-(furan-2-yl)-4-(6-methoxy-3-methylquinoxalin-2-yl)morpholine
CID 138993403
6-[2-(furan-2-yl)morpholin-4-yl]-N-methylpyridine-3-sulfonamide
CID 133347305
3-bromo-4-[4-[(3,4-difluorophenyl)methyl]piperidin-1-yl]-1-methylpyrazolo[5,4-d]pyrimidine
CID 133480597
2-(furan-2-yl)-4-(4-methyl-5-nitro-2-pyridinyl)morpholine
CID 133347026

Frequently Asked Questions

What is the IUPAC name of 4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine?
The IUPAC name of 4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine (CID 133347170) is 4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine.
What is the SMILES notation for 4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine?
The canonical SMILES for 4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine is Cn1nc(Br)c2c(N3CCOC(c4ccco4)C3)ncnc21.
What is the InChIKey of 4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine?
The InChIKey is GSCYZMBKZHUCRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrN5O2/c1-19-13-11(12(15)18-19)14(17-8-16-13)20-4-6-22-10(7-20)9-3-2-5-21-9/h2-3,5,8,10H,4,6-7H2,1H3.
What are the key properties of 4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine?
4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine has a molecular weight of 364.20 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-bromo-1-methylpyrazolo[5,4-d]pyrimidin-4-yl)-2-(furan-2-yl)morpholine is sourced from PubChem (CID 133347170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).