2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one

C13H19N3O2 — CID 113408683

IUPAC2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one
SMILESCc1cccnc1NC(C)C(=O)N1CCOCC1
InChIInChI=1S/C13H19N3O2/c1-10-4-3-5-14-12(10)15-11(2)13(17)16-6-8-18-9-7-16/h3-5,11H,6-9H2,1-2H3,(H,14,15)
InChIKeyRFAOHYYXIVKEHU-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.05
Rot. Bonds3

About 2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one

2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one (PubChem CID 113408683) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one
PubChem CID113408683
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one
SMILESCc1cccnc1NC(C)C(=O)N1CCOCC1
InChIInChI=1S/C13H19N3O2/c1-10-4-3-5-14-12(10)15-11(2)13(17)16-6-8-18-9-7-16/h3-5,11H,6-9H2,1-2H3,(H,14,15)
InChIKeyRFAOHYYXIVKEHU-UHFFFAOYSA-N
XLogP1.05
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3-fluoro-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one
CID 112551724
2-[(8-methylquinazolin-4-yl)amino]-1-morpholin-4-ylpropan-1-one
CID 133388467
N-(3-methyl-2-pyridinyl)morpholine-4-carboxamide
CID 3411498
2-[2-methyl-5-(pyridin-2-ylmethyl)anilino]-1-morpholin-4-ylpropan-1-one
CID 167964780
2-[(3-fluoro-2-pyridinyl)amino]-1-piperidin-1-ylpropan-1-one
CID 112551708
1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one
CID 81402403
3-bromo-N-(1-morpholin-4-yl-1-oxopropan-2-yl)pyridine-2-carboxamide
CID 107519294
1-(3-methyl-2-pyridinyl)-3-[(2S)-1-morpholin-4-ylpropan-2-yl]urea
CID 94102902
2-[(3-bromo-4-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one
CID 104777234
(2R)-2-(2-methyl-4-morpholin-4-ylanilino)-1-morpholin-4-ylpropan-1-one
CID 94114537
2-[(8-bromoquinolin-4-yl)amino]-1-morpholin-4-ylpropan-1-one
CID 133447521
2-[(2,5-dimethylthieno[2,3-d]pyrimidin-4-yl)amino]-1-morpholin-4-ylpropan-1-one
CID 75510015

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one (CID 113408683) is 2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one is Cc1cccnc1NC(C)C(=O)N1CCOCC1.
What is the InChIKey of 2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one?
The InChIKey is RFAOHYYXIVKEHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c1-10-4-3-5-14-12(10)15-11(2)13(17)16-6-8-18-9-7-16/h3-5,11H,6-9H2,1-2H3,(H,14,15).
What are the key properties of 2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one?
2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one has a molecular weight of 249.31 g/mol, XLogP of 1.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methyl-2-pyridinyl)amino]-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 113408683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).