3-(2,3-dihydropyridin-2-yl)morpholine

C9H14N2O — CID 91173291

IUPAC3-(2,3-dihydropyridin-2-yl)morpholine
SMILESC1=CCC(C2COCCN2)N=C1
InChIInChI=1S/C9H14N2O/c1-2-4-10-8(3-1)9-7-12-6-5-11-9/h1-2,4,8-9,11H,3,5-7H2
InChIKeyAJRSIDXUBAICGM-UHFFFAOYSA-N
MW166.22 g/mol
LogP0.37
Rot. Bonds1

About 3-(2,3-dihydropyridin-2-yl)morpholine

3-(2,3-dihydropyridin-2-yl)morpholine (PubChem CID 91173291) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 3-(2,3-dihydropyridin-2-yl)morpholine.

Molecular Properties

Compound Name3-(2,3-dihydropyridin-2-yl)morpholine
PubChem CID91173291
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name3-(2,3-dihydropyridin-2-yl)morpholine
SMILESC1=CCC(C2COCCN2)N=C1
InChIInChI=1S/C9H14N2O/c1-2-4-10-8(3-1)9-7-12-6-5-11-9/h1-2,4,8-9,11H,3,5-7H2
InChIKeyAJRSIDXUBAICGM-UHFFFAOYSA-N
XLogP0.37
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-[(3S)-morpholin-3-yl]morpholine
CID 11693975
(3S)-3-(5H-tetrazol-5-yl)morpholine
CID 129389237
3-[4-(trifluoromethyl)cyclohexyl]morpholine
CID 149088087
3-cyclohexylmorpholine
CID 54373245
trans-(1R,2S)-2-[(3S)-morpholin-3-yl]cyclopentan-1-ol
CID 124709951
2-morpholin-3-ylcyclohex-3-en-1-one
CID 155073585
(3-morpholin-3-ylcyclopentyl)azanium
CID 163746361
(3S)-3-(trifluoromethyl)morpholine
CID 52810917
1,2,3,3a,4,5,7,7a-octahydropyrano[3,4-b]pyrrole
CID 68902591
3-(6-azaspiro[2.5]octan-8-yl)morpholine
CID 167222320
3-morpholin-3-yl-2,3-dihydrochromen-4-one
CID 116698663
ethane;(3S)-3-methylmorpholine
CID 145275253

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydropyridin-2-yl)morpholine?
The IUPAC name of 3-(2,3-dihydropyridin-2-yl)morpholine (CID 91173291) is 3-(2,3-dihydropyridin-2-yl)morpholine.
What is the SMILES notation for 3-(2,3-dihydropyridin-2-yl)morpholine?
The canonical SMILES for 3-(2,3-dihydropyridin-2-yl)morpholine is C1=CCC(C2COCCN2)N=C1.
What is the InChIKey of 3-(2,3-dihydropyridin-2-yl)morpholine?
The InChIKey is AJRSIDXUBAICGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-2-4-10-8(3-1)9-7-12-6-5-11-9/h1-2,4,8-9,11H,3,5-7H2.
What are the key properties of 3-(2,3-dihydropyridin-2-yl)morpholine?
3-(2,3-dihydropyridin-2-yl)morpholine has a molecular weight of 166.22 g/mol, XLogP of 0.37, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydropyridin-2-yl)morpholine is sourced from PubChem (CID 91173291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).