3-(2,5-dimethylmorpholin-4-yl)propan-1-ol

C9H19NO2 — CID 43430768

IUPAC3-(2,5-dimethylmorpholin-4-yl)propan-1-ol
SMILESCC1CN(CCCO)C(C)CO1
InChIInChI=1S/C9H19NO2/c1-8-7-12-9(2)6-10(8)4-3-5-11/h8-9,11H,3-7H2,1-2H3
InChIKeyVTGCPPLIWBHIIV-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.48
Rot. Bonds3

About 3-(2,5-dimethylmorpholin-4-yl)propan-1-ol

3-(2,5-dimethylmorpholin-4-yl)propan-1-ol (PubChem CID 43430768) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 3-(2,5-dimethylmorpholin-4-yl)propan-1-ol.

Molecular Properties

Compound Name3-(2,5-dimethylmorpholin-4-yl)propan-1-ol
PubChem CID43430768
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name3-(2,5-dimethylmorpholin-4-yl)propan-1-ol
SMILESCC1CN(CCCO)C(C)CO1
InChIInChI=1S/C9H19NO2/c1-8-7-12-9(2)6-10(8)4-3-5-11/h8-9,11H,3-7H2,1-2H3
InChIKeyVTGCPPLIWBHIIV-UHFFFAOYSA-N
XLogP0.48
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-1-ol
CID 114286796
3-(5-ethyl-2-methylmorpholin-4-yl)propan-1-ol
CID 60692406
4-(2-iodoethyl)-2,5-dimethylmorpholine
CID 130977867
5-(5-ethyl-2-methylmorpholin-4-yl)pentan-1-ol
CID 62229159
methyl 4-(2,5-dimethylmorpholin-4-yl)butanoate
CID 43544788
3-(2,5-dimethylmorpholin-4-yl)propanethioamide
CID 43544623
5-[2-(aminomethyl)-5-methylmorpholin-4-yl]pentan-1-ol
CID 81217514
ethyl 6-[(2S,5S)-2,5-dimethylmorpholin-4-yl]hexanoate
CID 95392282
ethyl 6-[(2R,5S)-2,5-dimethylmorpholin-4-yl]hexanoate
CID 95392283
3-[(2S,5S)-2,5-dimethylmorpholin-4-yl]propanenitrile
CID 45088973
1-(2,5-dimethylmorpholin-4-yl)-4,4-dimethylpentan-3-ol
CID 62624456
4-(2,5-dimethylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine
CID 62432075

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dimethylmorpholin-4-yl)propan-1-ol?
The IUPAC name of 3-(2,5-dimethylmorpholin-4-yl)propan-1-ol (CID 43430768) is 3-(2,5-dimethylmorpholin-4-yl)propan-1-ol.
What is the SMILES notation for 3-(2,5-dimethylmorpholin-4-yl)propan-1-ol?
The canonical SMILES for 3-(2,5-dimethylmorpholin-4-yl)propan-1-ol is CC1CN(CCCO)C(C)CO1.
What is the InChIKey of 3-(2,5-dimethylmorpholin-4-yl)propan-1-ol?
The InChIKey is VTGCPPLIWBHIIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-8-7-12-9(2)6-10(8)4-3-5-11/h8-9,11H,3-7H2,1-2H3.
What are the key properties of 3-(2,5-dimethylmorpholin-4-yl)propan-1-ol?
3-(2,5-dimethylmorpholin-4-yl)propan-1-ol has a molecular weight of 173.26 g/mol, XLogP of 0.48, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dimethylmorpholin-4-yl)propan-1-ol is sourced from PubChem (CID 43430768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).