N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide

C21H19N5O2S — CID 67064569

IUPACN-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide
SMILESO=C(Nc1cc(N2CCOCC2)n2nccc2n1)c1ccc(-c2cccs2)cc1
InChIInChI=1S/C21H19N5O2S/c27-21(16-5-3-15(4-6-16)17-2-1-13-29-17)24-18-14-20(25-9-11-28-12-10-25)26-19(23-18)7-8-22-26/h1-8,13-14H,9-12H2,(H,23,24,27)
InChIKeyLAZMZQZNWQUCSG-UHFFFAOYSA-N
MW405.48 g/mol
LogP3.55
Rot. Bonds4

About N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide

N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide (PubChem CID 67064569) has the molecular formula C21H19N5O2S and a molecular weight of 405.48 g/mol. Its IUPAC name is N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide.

Molecular Properties

Compound NameN-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide
PubChem CID67064569
Molecular FormulaC21H19N5O2S
Molecular Weight405.48 g/mol
Exact Mass405.13
IUPAC NameN-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide
SMILESO=C(Nc1cc(N2CCOCC2)n2nccc2n1)c1ccc(-c2cccs2)cc1
InChIInChI=1S/C21H19N5O2S/c27-21(16-5-3-15(4-6-16)17-2-1-13-29-17)24-18-14-20(25-9-11-28-12-10-25)26-19(23-18)7-8-22-26/h1-8,13-14H,9-12H2,(H,23,24,27)
InChIKeyLAZMZQZNWQUCSG-UHFFFAOYSA-N
XLogP3.55
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.48
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide 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-morpholin-4-yl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide
CID 67064614
3-methyl-N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide
CID 67064544
N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-(5-oxo-4H-1,4-thiazin-3-yl)benzamide
CID 67064515
4-(2-hydroxypropan-2-yl)-N-(7-piperidin-1-ylpyrazolo[1,5-a]pyrimidin-5-yl)benzamide
CID 143873056
N-(4-morpholin-4-ylphenyl)-3-thiophen-2-ylbenzamide
CID 117093174
4-tert-butyl-N-[7-[3-(hydroxymethyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-5-yl]benzamide
CID 70961385
1-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)ethanone
CID 58206932
N-[7-[3-(dimethylamino)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-5-yl]-4-(2-hydroxypropan-2-yl)benzamide
CID 67064055
N-[(3-methylphenyl)methylideneamino]-7-morpholin-4-yl-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidin-5-amine
CID 75216468
methyl 4-[2-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)acetyl]benzoate
CID 58207276
N-naphthalen-2-yl-4-thiophen-2-ylbenzamide
CID 59673380
7-methyl-N-(4-morpholin-4-ylphenyl)-2-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 53040519

Frequently Asked Questions

What is the IUPAC name of N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide?
The IUPAC name of N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide (CID 67064569) is N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide.
What is the SMILES notation for N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide?
The canonical SMILES for N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide is O=C(Nc1cc(N2CCOCC2)n2nccc2n1)c1ccc(-c2cccs2)cc1.
What is the InChIKey of N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide?
The InChIKey is LAZMZQZNWQUCSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O2S/c27-21(16-5-3-15(4-6-16)17-2-1-13-29-17)24-18-14-20(25-9-11-28-12-10-25)26-19(23-18)7-8-22-26/h1-8,13-14H,9-12H2,(H,23,24,27).
What are the key properties of N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide?
N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide has a molecular weight of 405.48 g/mol, XLogP of 3.55, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)-4-thiophen-2-ylbenzamide is sourced from PubChem (CID 67064569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).