N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide

C22H24N4O2 — CID 71870397

IUPACN-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide
SMILESCc1nn(-c2ccccc2)c(C)c1NC(=O)N1CCOCC1c1ccccc1
InChIInChI=1S/C22H24N4O2/c1-16-21(17(2)26(24-16)19-11-7-4-8-12-19)23-22(27)25-13-14-28-15-20(25)18-9-5-3-6-10-18/h3-12,20H,13-15H2,1-2H3,(H,23,27)
InChIKeyZSEWRFXZYYFDAW-UHFFFAOYSA-N
MW376.46 g/mol
LogP4.09
Rot. Bonds3

About N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide

N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide (PubChem CID 71870397) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide
PubChem CID71870397
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC NameN-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide
SMILESCc1nn(-c2ccccc2)c(C)c1NC(=O)N1CCOCC1c1ccccc1
InChIInChI=1S/C22H24N4O2/c1-16-21(17(2)26(24-16)19-11-7-4-8-12-19)23-22(27)25-13-14-28-15-20(25)18-9-5-3-6-10-18/h3-12,20H,13-15H2,1-2H3,(H,23,27)
InChIKeyZSEWRFXZYYFDAW-UHFFFAOYSA-N
XLogP4.09
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-morpholin-4-ylpiperidine-1-carboxamide
CID 45237197
N-(3,5-dimethyl-1-phenylpyrazol-4-yl)oxane-4-carboxamide
CID 51279535
N-(4-acetylphenyl)-3-phenylmorpholine-4-carboxamide
CID 84525724
ethyl 4-[(3-phenylmorpholine-4-carbonyl)amino]benzoate
CID 130248478
N-(2,2-dimethylpropyl)-3-phenylmorpholine-4-carboxamide
CID 110748599
N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-oxa-7-azaspiro[4.4]nonane-7-carboxamide
CID 126792098
[3-(3,5-dimethyl-1-phenylpyrazol-4-yl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone
CID 75473685
2-[3-(3,5-dimethyl-1-phenylpyrazol-4-yl)morpholin-4-yl]-N,N-dimethylacetamide
CID 75474361
4-[[[(3R)-3-phenylmorpholine-4-carbonyl]amino]methyl]benzoic acid
CID 129468648
1-[3-(3,5-dimethyl-1-phenylpyrazol-4-yl)morpholin-4-yl]-3-pyridin-3-ylpropan-1-one
CID 75473692
N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-phenylsulfanylacetamide
CID 78762299
1-tert-butyl-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)urea
CID 78834613

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide?
The IUPAC name of N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide (CID 71870397) is N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide.
What is the SMILES notation for N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide?
The canonical SMILES for N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide is Cc1nn(-c2ccccc2)c(C)c1NC(=O)N1CCOCC1c1ccccc1.
What is the InChIKey of N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide?
The InChIKey is ZSEWRFXZYYFDAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-16-21(17(2)26(24-16)19-11-7-4-8-12-19)23-22(27)25-13-14-28-15-20(25)18-9-5-3-6-10-18/h3-12,20H,13-15H2,1-2H3,(H,23,27).
What are the key properties of N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide?
N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 4.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-3-phenylmorpholine-4-carboxamide is sourced from PubChem (CID 71870397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).