N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide

C19H22N6O3 — CID 154877200

IUPACN-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide
SMILESN#Cc1c(N2CCOCC2)n[nH]c1NC(=O)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C19H22N6O3/c20-13-16-17(22-23-18(16)25-7-11-28-12-8-25)21-19(26)14-1-3-15(4-2-14)24-5-9-27-10-6-24/h1-4H,5-12H2,(H2,21,22,23,26)
InChIKeyOXTUNUJIXCJFEE-UHFFFAOYSA-N
MW382.42 g/mol
LogP1.21
Rot. Bonds4

About N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide

N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide (PubChem CID 154877200) has the molecular formula C19H22N6O3 and a molecular weight of 382.42 g/mol. Its IUPAC name is N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide.

Molecular Properties

Compound NameN-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide
PubChem CID154877200
Molecular FormulaC19H22N6O3
Molecular Weight382.42 g/mol
Exact Mass382.18
IUPAC NameN-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide
SMILESN#Cc1c(N2CCOCC2)n[nH]c1NC(=O)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C19H22N6O3/c20-13-16-17(22-23-18(16)25-7-11-28-12-8-25)21-19(26)14-1-3-15(4-2-14)24-5-9-27-10-6-24/h1-4H,5-12H2,(H2,21,22,23,26)
InChIKeyOXTUNUJIXCJFEE-UHFFFAOYSA-N
XLogP1.21
TPSA106.51 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.42
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-6-methylpyridine-3-carboxamide
CID 154877207
N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-cyclobutylsulfonylbenzamide
CID 167865252
N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-1-(4-fluoro-2-methylphenyl)pyrazole-3-carboxamide
CID 166371043
4-morpholin-4-yl-N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]benzamide
CID 67686927
4-acetyl-N-(4-morpholin-4-ylphenyl)benzamide
CID 803418
N-(2,4-difluorophenyl)-4-morpholin-4-ylbenzamide
CID 53282259
N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]-4-piperazin-1-ylbenzamide
CID 67112495
N-(1,3-benzothiazol-2-yl)-4-morpholin-4-ylbenzamide
CID 146405947
4-fluoro-N-(2-morpholin-4-yl-5-pyrrolidin-1-ylphenyl)benzamide
CID 110400459
N,N-dimethyl-4-[(4-morpholin-4-ylbenzoyl)amino]benzamide
CID 70703870
4-fluoro-N-(5-fluoro-2-morpholin-4-ylphenyl)benzamide
CID 113092686
1-(4-morpholin-4-ylbenzoyl)pyrrole-3-carbonitrile
CID 91373755

Frequently Asked Questions

What is the IUPAC name of N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide?
The IUPAC name of N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide (CID 154877200) is N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide.
What is the SMILES notation for N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide?
The canonical SMILES for N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide is N#Cc1c(N2CCOCC2)n[nH]c1NC(=O)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide?
The InChIKey is OXTUNUJIXCJFEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O3/c20-13-16-17(22-23-18(16)25-7-11-28-12-8-25)21-19(26)14-1-3-15(4-2-14)24-5-9-27-10-6-24/h1-4H,5-12H2,(H2,21,22,23,26).
What are the key properties of N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide?
N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide has a molecular weight of 382.42 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyano-3-morpholin-4-yl-1H-pyrazol-5-yl)-4-morpholin-4-ylbenzamide is sourced from PubChem (CID 154877200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).