(2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide

C19H26N4O2 — CID 99829614

IUPAC(2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide
SMILESCCc1ccc([C@@H]2CN(C(=O)NCCc3ccnn3C)CCO2)cc1
InChIInChI=1S/C19H26N4O2/c1-3-15-4-6-16(7-5-15)18-14-23(12-13-25-18)19(24)20-10-8-17-9-11-21-22(17)2/h4-7,9,11,18H,3,8,10,12-14H2,1-2H3,(H,20,24)/t18-/m0/s1
InChIKeyGOXOZJLYVZPPFC-SFHVURJKSA-N
MW342.44 g/mol
LogP2.31
Rot. Bonds5

About (2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide

(2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide (PubChem CID 99829614) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is (2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name(2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide
PubChem CID99829614
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC Name(2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide
SMILESCCc1ccc([C@@H]2CN(C(=O)NCCc3ccnn3C)CCO2)cc1
InChIInChI=1S/C19H26N4O2/c1-3-15-4-6-16(7-5-15)18-14-23(12-13-25-18)19(24)20-10-8-17-9-11-21-22(17)2/h4-7,9,11,18H,3,8,10,12-14H2,1-2H3,(H,20,24)/t18-/m0/s1
InChIKeyGOXOZJLYVZPPFC-SFHVURJKSA-N
XLogP2.31
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine
CID 71656802
3-[[4-(2-Methylpyrazol-3-yl)phenyl]-phenylmethoxy]azetidine-1-carbonitrile
CID 156018646
(2S)-2-[4-[1-(4-fluorophenyl)pyrazol-4-yl]phenyl]morpholine
CID 71656801
N-[2-(3-phenylpyrazol-1-yl)ethyl]morpholine-4-carboxamide
CID 155513256
N-[2-[3-(3-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide
CID 155537385
N-[2-[3-(4-methoxyphenyl)pyrazol-1-yl]ethyl]piperidine-1-carboxamide
CID 155566254
2-[(4-Fluorophenyl)-(2-methylpyrazol-3-yl)methoxy]-1-morpholin-4-ylethanone
CID 45488337
3-[(2-fluorophenyl)methoxymethyl]-N-(2-methoxyethyl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide
CID 53018267
N-(2-Fluorophenyl)-1-methyl-3-{[(4-methylphenyl)methoxy]methyl}-1H,4H,5H,6H,7H-pyrazolo[4,3-C]pyridine-5-carboxamide
CID 53018314
N-(3-Fluorophenyl)-1-methyl-3-{[(4-methylphenyl)methoxy]methyl}-1H,4H,5H,6H,7H-pyrazolo[4,3-C]pyridine-5-carboxamide
CID 53018315
3-{[(3-Fluorophenyl)methoxy]methyl}-1-methyl-N-(propan-2-YL)-1H,4H,5H,6H,7H-pyrazolo[4,3-C]pyridine-5-carboxamide
CID 53018329
2-({6-[4-(4-methoxyphenyl)piperazin-1-yl]pyrimidin-4-yl}thio)-N-(2-methylphenyl)acetamide
CID 53018349

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide?
The IUPAC name of (2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide (CID 99829614) is (2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide.
What is the SMILES notation for (2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide?
The canonical SMILES for (2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide is CCc1ccc([C@@H]2CN(C(=O)NCCc3ccnn3C)CCO2)cc1.
What is the InChIKey of (2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide?
The InChIKey is GOXOZJLYVZPPFC-SFHVURJKSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-3-15-4-6-16(7-5-15)18-14-23(12-13-25-18)19(24)20-10-8-17-9-11-21-22(17)2/h4-7,9,11,18H,3,8,10,12-14H2,1-2H3,(H,20,24)/t18-/m0/s1.
What are the key properties of (2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide?
(2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide has a molecular weight of 342.44 g/mol, XLogP of 2.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-ethylphenyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]morpholine-4-carboxamide is sourced from PubChem (CID 99829614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).