[2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone

C12H17N3O2 — CID 62168003

IUPAC[2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone
SMILESCNc1ncccc1C(=O)N1CCOCC1C
InChIInChI=1S/C12H17N3O2/c1-9-8-17-7-6-15(9)12(16)10-4-3-5-14-11(10)13-2/h3-5,9H,6-8H2,1-2H3,(H,13,14)
InChIKeyRZBNLDLFELQPAB-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.98
Rot. Bonds2

About [2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone

[2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone (PubChem CID 62168003) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is [2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name[2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone
PubChem CID62168003
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC Name[2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone
SMILESCNc1ncccc1C(=O)N1CCOCC1C
InChIInChI=1S/C12H17N3O2/c1-9-8-17-7-6-15(9)12(16)10-4-3-5-14-11(10)13-2/h3-5,9H,6-8H2,1-2H3,(H,13,14)
InChIKeyRZBNLDLFELQPAB-UHFFFAOYSA-N
XLogP0.98
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2-hydrazinyl-3-pyridinyl)-(3-methylmorpholin-4-yl)methanone
CID 62243394
(2-bromo-3-pyridinyl)-(3-methylmorpholin-4-yl)methanone
CID 103752337
[2-(methylamino)-3-pyridinyl]-[(1S,5S)-7-methyl-3-oxa-7,9-diazabicyclo[3.3.2]decan-9-yl]methanone
CID 135088216
2-[(3S)-3-methylmorpholine-4-carbonyl]benzonitrile
CID 130179782
[2-(methylamino)-4-pyridinyl]-(3-methylmorpholin-4-yl)methanone
CID 55047498
(3,5-dimethylpiperidin-1-yl)-[2-(methylamino)-3-pyridinyl]methanone
CID 62166241
[2-[2-(methylamino)ethyl]phenyl]-[(3R)-3-methylmorpholin-4-yl]methanone
CID 106774377
(2,5-dimethylmorpholin-4-yl)-(2-hydrazinyl-3-pyridinyl)methanone
CID 62242697
N-methyl-3-(3-methylmorpholin-4-yl)sulfonylpyridin-2-amine
CID 62146970
[6-[(dimethylamino)methyl]-1,4-oxazepan-4-yl]-[2-(methylamino)-3-pyridinyl]methanone;formic acid
CID 154910507
[2-(methylamino)-3-pyridinyl]-(3-methylpiperidin-1-yl)methanone
CID 62172050
1H-indol-7-yl-[(3R)-3-methylmorpholin-4-yl]methanone
CID 106834546

Frequently Asked Questions

What is the IUPAC name of [2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone?
The IUPAC name of [2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone (CID 62168003) is [2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone.
What is the SMILES notation for [2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone?
The canonical SMILES for [2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone is CNc1ncccc1C(=O)N1CCOCC1C.
What is the InChIKey of [2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone?
The InChIKey is RZBNLDLFELQPAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c1-9-8-17-7-6-15(9)12(16)10-4-3-5-14-11(10)13-2/h3-5,9H,6-8H2,1-2H3,(H,13,14).
What are the key properties of [2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone?
[2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone has a molecular weight of 235.29 g/mol, XLogP of 0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(methylamino)-3-pyridinyl]-(3-methylmorpholin-4-yl)methanone is sourced from PubChem (CID 62168003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).