(2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide

C12H15N3O3 — CID 95839438

IUPAC(2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide
SMILESCNC(=O)[C@H]1CN(C(=O)c2ccncc2)CCO1
InChIInChI=1S/C12H15N3O3/c1-13-11(16)10-8-15(6-7-18-10)12(17)9-2-4-14-5-3-9/h2-5,10H,6-8H2,1H3,(H,13,16)/t10-/m1/s1
InChIKeyLDTDMYRCCKXBSD-SNVBAGLBSA-N
MW249.27 g/mol
LogP-0.33
Rot. Bonds2

About (2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide

(2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide (PubChem CID 95839438) has the molecular formula C12H15N3O3 and a molecular weight of 249.27 g/mol. Its IUPAC name is (2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide
PubChem CID95839438
Molecular FormulaC12H15N3O3
Molecular Weight249.27 g/mol
Exact Mass249.11
IUPAC Name(2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide
SMILESCNC(=O)[C@H]1CN(C(=O)c2ccncc2)CCO1
InChIInChI=1S/C12H15N3O3/c1-13-11(16)10-8-15(6-7-18-10)12(17)9-2-4-14-5-3-9/h2-5,10H,6-8H2,1H3,(H,13,16)/t10-/m1/s1
InChIKeyLDTDMYRCCKXBSD-SNVBAGLBSA-N
XLogP-0.33
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-4-(3-bromo-5-methylbenzoyl)-N-methylmorpholine-2-carboxamide
CID 99629408
N-methyl-1-(pyridine-4-carbonyl)piperidine-3-carboxamide
CID 110258723
[2-(1-aminoethyl)morpholin-4-yl]-pyridin-4-ylmethanone
CID 81484704
(2R)-N-cyclopentyl-4-[2-(methylamino)pyridine-4-carbonyl]morpholine-2-carboxamide
CID 92633303
N-cyclopentyl-4-[2-(methylamino)pyridine-4-carbonyl]morpholine-2-carboxamide
CID 110246675
N-methyl-4-(2-phenylacetyl)morpholine-2-carboxamide
CID 110268197
(2R)-N-methyl-4-(2-phenylacetyl)morpholine-2-carboxamide
CID 95839396
(2S)-2-N-methyl-4-N-[4-(trifluoromethyl)phenyl]morpholine-2,4-dicarboxamide
CID 97348704
pyridin-4-yl-(2-pyridin-2-ylmorpholin-4-yl)methanone
CID 110270765
4-[2-(2-fluoroanilino)pyridine-3-carbonyl]-N-methylmorpholine-2-carboxamide
CID 126787902
N-methyl-4-pyrazin-2-ylmorpholine-2-carboxamide
CID 110268192
[4-(methylamino)phenyl]-(2-methylmorpholin-4-yl)methanone
CID 62173081

Frequently Asked Questions

What is the IUPAC name of (2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide?
The IUPAC name of (2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide (CID 95839438) is (2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide.
What is the SMILES notation for (2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide?
The canonical SMILES for (2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide is CNC(=O)[C@H]1CN(C(=O)c2ccncc2)CCO1.
What is the InChIKey of (2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide?
The InChIKey is LDTDMYRCCKXBSD-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H15N3O3/c1-13-11(16)10-8-15(6-7-18-10)12(17)9-2-4-14-5-3-9/h2-5,10H,6-8H2,1H3,(H,13,16)/t10-/m1/s1.
What are the key properties of (2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide?
(2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide has a molecular weight of 249.27 g/mol, XLogP of -0.33, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-methyl-4-(pyridine-4-carbonyl)morpholine-2-carboxamide is sourced from PubChem (CID 95839438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).