N-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide

C13H22N4O2 — CID 84597782

IUPACN-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide
SMILESCCc1nn(C)cc1NC(=O)N1CCOC(C)C1C
InChIInChI=1S/C13H22N4O2/c1-5-11-12(8-16(4)15-11)14-13(18)17-6-7-19-10(3)9(17)2/h8-10H,5-7H2,1-4H3,(H,14,18)
InChIKeySDTCBMLNGCEPAG-UHFFFAOYSA-N
MW266.34 g/mol
LogP1.62
Rot. Bonds2

About N-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide

N-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide (PubChem CID 84597782) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide
PubChem CID84597782
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC NameN-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide
SMILESCCc1nn(C)cc1NC(=O)N1CCOC(C)C1C
InChIInChI=1S/C13H22N4O2/c1-5-11-12(8-16(4)15-11)14-13(18)17-6-7-19-10(3)9(17)2/h8-10H,5-7H2,1-4H3,(H,14,18)
InChIKeySDTCBMLNGCEPAG-UHFFFAOYSA-N
XLogP1.62
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-ethyl-1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide
CID 103908575
(2R)-N-(3-ethyl-1-methylpyrazol-4-yl)-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide
CID 97340363
2-[(3-ethyl-1-methylpyrazol-4-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 107462239
2,3-dimethyl-N-(2-methyl-6-pyrrolidin-1-yl-3-pyridinyl)morpholine-4-carboxamide
CID 84597190
cis-(1R,3S)-3-[(3-ethyl-1-methylpyrazol-4-yl)carbamoylamino]cyclopentane-1-carboxylic acid
CID 106320313
N-[3-(dimethylamino)-2-methylphenyl]-2,3-dimethylmorpholine-4-carboxamide
CID 75499475
1-(3-ethyl-1-methylpyrazol-4-yl)-3-[(S)-[(2S)-oxolan-2-yl]-phenylmethyl]urea
CID 125136365
(2S,3S)-2,3-dimethyl-N-[3-(2-methylpropanoylamino)phenyl]morpholine-4-carboxamide
CID 97253592
N-(3-ethyl-1-methylpyrazol-4-yl)-6-methylpiperidine-2-carboxamide
CID 107463362
3-amino-N-(3-ethyl-1-methylpyrazol-4-yl)-3-sulfanylidenepropanamide
CID 107463267
4-N-(3-ethyl-1-methylpyrazol-4-yl)-1-N,1-N-dimethylpiperidine-1,4-dicarboxamide
CID 154781611
4-amino-N-(3-ethyl-1-methylpyrazol-4-yl)cyclopent-2-ene-1-carboxamide
CID 107463151

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide?
The IUPAC name of N-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide (CID 84597782) is N-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide.
What is the SMILES notation for N-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide?
The canonical SMILES for N-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide is CCc1nn(C)cc1NC(=O)N1CCOC(C)C1C.
What is the InChIKey of N-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide?
The InChIKey is SDTCBMLNGCEPAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-5-11-12(8-16(4)15-11)14-13(18)17-6-7-19-10(3)9(17)2/h8-10H,5-7H2,1-4H3,(H,14,18).
What are the key properties of N-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide?
N-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide has a molecular weight of 266.34 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-1-methylpyrazol-4-yl)-2,3-dimethylmorpholine-4-carboxamide is sourced from PubChem (CID 84597782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).