(2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide

C11H18N4O2 — CID 120942299

IUPAC(2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide
SMILESC[C@H]1OCCN[C@@H]1C(=O)N(C)c1cnn(C)c1
InChIInChI=1S/C11H18N4O2/c1-8-10(12-4-5-17-8)11(16)15(3)9-6-13-14(2)7-9/h6-8,10,12H,4-5H2,1-3H3/t8-,10+/m1/s1
InChIKeyHUURLHXBUFGMLY-SCZZXKLOSA-N
MW238.29 g/mol
LogP-0.24
Rot. Bonds2

About (2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide

(2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide (PubChem CID 120942299) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is (2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide.

Molecular Properties

Compound Name(2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide
PubChem CID120942299
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name(2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide
SMILESC[C@H]1OCCN[C@@H]1C(=O)N(C)c1cnn(C)c1
InChIInChI=1S/C11H18N4O2/c1-8-10(12-4-5-17-8)11(16)15(3)9-6-13-14(2)7-9/h6-8,10,12H,4-5H2,1-3H3/t8-,10+/m1/s1
InChIKeyHUURLHXBUFGMLY-SCZZXKLOSA-N
XLogP-0.24
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 5-0.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R,3S)-N,2-dimethyl-N-(4-methylsulfanylphenyl)morpholine-3-carboxamide
CID 120931748
N-methyl-N-(1-methylpyrazol-4-yl)pyrrolidine-2-carboxamide
CID 119893081
(2-methylmorpholin-3-yl)-(2-methyltriazol-4-yl)methanone
CID 130625566
(2R,3S)-N,2-dimethyl-N-(2-pyrazol-1-ylethyl)morpholine-3-carboxamide
CID 120941752
(2R,3S)-N,2-dimethyl-N-[(1-phenylpyrazol-4-yl)methyl]morpholine-3-carboxamide
CID 120920037
N-methyl-N-(1-methylpyrazol-4-yl)piperidine-3-carboxamide;dihydrochloride
CID 119893048
(2R,3S)-N-cyclopentyl-N,2-dimethylmorpholine-3-carboxamide;hydrochloride
CID 120920305
(2R,3S)-N-[5-(dimethylamino)-2-pyridinyl]-2-methylmorpholine-3-carboxamide
CID 120940037
(2R,3S)-N,2-dimethyl-N-(1,3-thiazol-4-ylmethyl)morpholine-3-carboxamide
CID 120940162
(2R,3S)-N,2-dimethyl-N-[(4-methylphenyl)methyl]morpholine-3-carboxamide;hydrochloride
CID 120918446
(2R,3S)-N,2-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]morpholine-3-carboxamide
CID 120920338
(2R,3S)-N-[(2-fluorophenyl)methyl]-N,2-dimethylmorpholine-3-carboxamide
CID 120918482

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide?
The IUPAC name of (2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide (CID 120942299) is (2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide.
What is the SMILES notation for (2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide?
The canonical SMILES for (2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide is C[C@H]1OCCN[C@@H]1C(=O)N(C)c1cnn(C)c1.
What is the InChIKey of (2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide?
The InChIKey is HUURLHXBUFGMLY-SCZZXKLOSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-8-10(12-4-5-17-8)11(16)15(3)9-6-13-14(2)7-9/h6-8,10,12H,4-5H2,1-3H3/t8-,10+/m1/s1.
What are the key properties of (2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide?
(2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide has a molecular weight of 238.29 g/mol, XLogP of -0.24, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-N,2-dimethyl-N-(1-methylpyrazol-4-yl)morpholine-3-carboxamide is sourced from PubChem (CID 120942299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).