N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide

C19H26N4O2 — CID 122134228

IUPACN-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
SMILESCc1n[nH]c(C)c1CC(=O)Nc1ccccc1N1CC(C)OC(C)C1
InChIInChI=1S/C19H26N4O2/c1-12-10-23(11-13(2)25-12)18-8-6-5-7-17(18)20-19(24)9-16-14(3)21-22-15(16)4/h5-8,12-13H,9-11H2,1-4H3,(H,20,24)(H,21,22)
InChIKeyOCBMNXUEZCPOOZ-UHFFFAOYSA-N
MW342.44 g/mol
LogP2.82
Rot. Bonds4

About N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide

N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide (PubChem CID 122134228) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide.

Molecular Properties

Compound NameN-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
PubChem CID122134228
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC NameN-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
SMILESCc1n[nH]c(C)c1CC(=O)Nc1ccccc1N1CC(C)OC(C)C1
InChIInChI=1S/C19H26N4O2/c1-12-10-23(11-13(2)25-12)18-8-6-5-7-17(18)20-19(24)9-16-14(3)21-22-15(16)4/h5-8,12-13H,9-11H2,1-4H3,(H,20,24)(H,21,22)
InChIKeyOCBMNXUEZCPOOZ-UHFFFAOYSA-N
XLogP2.82
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-2-ethylsulfonylacetamide
CID 94469385
N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3,4,4-trimethylpentanamide
CID 86901306
1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-3-propylurea
CID 94154582
1-(cyclopropylmethyl)-3-[2-(2,6-dimethylmorpholin-4-yl)phenyl]urea
CID 51085659
N-(4-bromo-2-methylphenyl)-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
CID 110695334
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-(4-fluoro-2-methylphenyl)acetamide
CID 51072997
1-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-3-(4-hydroxyphenyl)urea
CID 124618726
N'-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-N-[(2R)-2-hydroxypropyl]oxamide
CID 94444100
3-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]phenyl]-1-[(2-hydroxyphenyl)methyl]-1-methylurea
CID 94154697
(E)-N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-3-phenylprop-2-enamide
CID 60533436
(2S)-N-[2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]phenyl]-2-methylmorpholine-4-carboxamide
CID 94154647
(2S,4S)-N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-methylpiperidine-4-carboxamide
CID 120633562

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide?
The IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide (CID 122134228) is N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide.
What is the SMILES notation for N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide?
The canonical SMILES for N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide is Cc1n[nH]c(C)c1CC(=O)Nc1ccccc1N1CC(C)OC(C)C1.
What is the InChIKey of N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide?
The InChIKey is OCBMNXUEZCPOOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-12-10-23(11-13(2)25-12)18-8-6-5-7-17(18)20-19(24)9-16-14(3)21-22-15(16)4/h5-8,12-13H,9-11H2,1-4H3,(H,20,24)(H,21,22).
What are the key properties of N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide?
N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide has a molecular weight of 342.44 g/mol, XLogP of 2.82, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dimethylmorpholin-4-yl)phenyl]-2-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide is sourced from PubChem (CID 122134228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).