(2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide

C11H16N4O3 — CID 95815549

IUPAC(2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide
SMILESCn1ccc(C(=O)N2CCO[C@@](C)(C(N)=O)C2)n1
InChIInChI=1S/C11H16N4O3/c1-11(10(12)17)7-15(5-6-18-11)9(16)8-3-4-14(2)13-8/h3-4H,5-7H2,1-2H3,(H2,12,17)/t11-/m1/s1
InChIKeyNSMKBJUXRARDGC-LLVKDONJSA-N
MW252.27 g/mol
LogP-0.86
Rot. Bonds2

About (2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide

(2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide (PubChem CID 95815549) has the molecular formula C11H16N4O3 and a molecular weight of 252.27 g/mol. Its IUPAC name is (2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide.

Molecular Properties

Compound Name(2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide
PubChem CID95815549
Molecular FormulaC11H16N4O3
Molecular Weight252.27 g/mol
Exact Mass252.12
IUPAC Name(2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide
SMILESCn1ccc(C(=O)N2CCO[C@@](C)(C(N)=O)C2)n1
InChIInChI=1S/C11H16N4O3/c1-11(10(12)17)7-15(5-6-18-11)9(16)8-3-4-14(2)13-8/h3-4H,5-7H2,1-2H3,(H2,12,17)/t11-/m1/s1
InChIKeyNSMKBJUXRARDGC-LLVKDONJSA-N
XLogP-0.86
TPSA90.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 5-0.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N,2-trimethyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide
CID 110253416
(2S)-N,2-dimethyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide
CID 95815552
1,4-dioxa-9-azaspiro[4.5]decan-9-yl-(1-methylpyrazol-3-yl)methanone
CID 103860781
2-methyl-4-(5-methylimidazo[1,2-a]pyridine-2-carbonyl)morpholine-2-carboxamide
CID 110268384
(2R)-2-methyl-4-[3-(1,2,4-triazol-4-yl)benzoyl]morpholine-2-carboxamide
CID 95839705
(2R)-4-(1-ethylpyrazole-4-carbonyl)-2-methylmorpholine-2-carboxamide
CID 95839579
4-(1,2-dimethylindole-3-carbonyl)-2-methylmorpholine-2-carboxamide
CID 110268334
(4-methylpiperazin-1-yl)-(1-methylpyrazol-3-yl)methanone
CID 2172453
(1-methylpyrazol-3-yl)-piperidin-1-ylmethanone
CID 19577577
N'-hydroxy-4-methyl-1-(1-methylpyrazole-3-carbonyl)piperidine-4-carboximidamide
CID 107162442
(2R)-4-(2-methoxypyridine-3-carbonyl)-2-methylmorpholine-2-carboxamide
CID 125015588
(2R)-4-[4-[(dimethylamino)methyl]benzoyl]-2-methylmorpholine-2-carboxamide
CID 95838161

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide?
The IUPAC name of (2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide (CID 95815549) is (2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide.
What is the SMILES notation for (2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide?
The canonical SMILES for (2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide is Cn1ccc(C(=O)N2CCO[C@@](C)(C(N)=O)C2)n1.
What is the InChIKey of (2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide?
The InChIKey is NSMKBJUXRARDGC-LLVKDONJSA-N. The full InChI is InChI=1S/C11H16N4O3/c1-11(10(12)17)7-15(5-6-18-11)9(16)8-3-4-14(2)13-8/h3-4H,5-7H2,1-2H3,(H2,12,17)/t11-/m1/s1.
What are the key properties of (2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide?
(2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide has a molecular weight of 252.27 g/mol, XLogP of -0.86, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-4-(1-methylpyrazole-3-carbonyl)morpholine-2-carboxamide is sourced from PubChem (CID 95815549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).