(2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide

C13H20N4O2 — CID 92632634

IUPAC(2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide
SMILESCNc1ncccc1CN1CCO[C@](C)(C(N)=O)C1
InChIInChI=1S/C13H20N4O2/c1-13(12(14)18)9-17(6-7-19-13)8-10-4-3-5-16-11(10)15-2/h3-5H,6-9H2,1-2H3,(H2,14,18)(H,15,16)/t13-/m0/s1
InChIKeyWYTVITOEELSPDK-ZDUSSCGKSA-N
MW264.33 g/mol
LogP0.20
Rot. Bonds4

About (2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide

(2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide (PubChem CID 92632634) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is (2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide.

Molecular Properties

Compound Name(2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide
PubChem CID92632634
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC Name(2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide
SMILESCNc1ncccc1CN1CCO[C@](C)(C(N)=O)C1
InChIInChI=1S/C13H20N4O2/c1-13(12(14)18)9-17(6-7-19-13)8-10-4-3-5-16-11(10)15-2/h3-5H,6-9H2,1-2H3,(H2,14,18)(H,15,16)/t13-/m0/s1
InChIKeyWYTVITOEELSPDK-ZDUSSCGKSA-N
XLogP0.20
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide
CID 110253457
(2S)-N,2-dimethyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide
CID 92632636
(2R)-2-methyl-4-[(2-pyrrolidin-1-ylphenyl)methyl]morpholine-2-carboxamide
CID 95839767
3-[(2,2-dimethylmorpholin-4-yl)methyl]-N-ethylpyridin-2-amine
CID 62470276
N,N,2-trimethyl-4-(quinolin-8-ylmethyl)morpholine-2-carboxamide
CID 127247739
N-methyl-3-(1,4-oxazepan-4-ylmethyl)pyridin-2-amine
CID 62973167
3-[[(2R)-2-carbamoyl-2-methylmorpholin-4-yl]methyl]benzoic acid
CID 124945933
2-methyl-4-(thiophen-3-ylmethyl)morpholine-2-carboxamide
CID 110268312
2-[4-[(2-carbamoyl-2-methylmorpholin-4-yl)methyl]phenoxy]acetic acid
CID 132948171
N-methyl-3-[(1-oxo-1,4-thiazinan-4-yl)methyl]pyridin-2-amine
CID 62471252
(2R)-2-methyl-4-[(4-methylsulfonylphenyl)methyl]morpholine-2-carboxamide
CID 124983073
3-[[2-(methylamino)-3-pyridinyl]methyl]-1,3-oxazolidin-2-one
CID 62465616

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide?
The IUPAC name of (2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide (CID 92632634) is (2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide.
What is the SMILES notation for (2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide?
The canonical SMILES for (2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide is CNc1ncccc1CN1CCO[C@](C)(C(N)=O)C1.
What is the InChIKey of (2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide?
The InChIKey is WYTVITOEELSPDK-ZDUSSCGKSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-13(12(14)18)9-17(6-7-19-13)8-10-4-3-5-16-11(10)15-2/h3-5H,6-9H2,1-2H3,(H2,14,18)(H,15,16)/t13-/m0/s1.
What are the key properties of (2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide?
(2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide has a molecular weight of 264.33 g/mol, XLogP of 0.20, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methyl-4-[[2-(methylamino)-3-pyridinyl]methyl]morpholine-2-carboxamide is sourced from PubChem (CID 92632634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).