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

C9H19NO2 — CID 54352391

IUPAC3-(3,3-dimethylmorpholin-4-yl)propan-1-ol
SMILESCC1(C)COCCN1CCCO
InChIInChI=1S/C9H19NO2/c1-9(2)8-12-7-5-10(9)4-3-6-11/h11H,3-8H2,1-2H3
InChIKeyUGRMRDHEPJNRNE-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.48
Rot. Bonds3

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

3-(3,3-dimethylmorpholin-4-yl)propan-1-ol (PubChem CID 54352391) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 3-(3,3-dimethylmorpholin-4-yl)propan-1-ol.

Molecular Properties

Compound Name3-(3,3-dimethylmorpholin-4-yl)propan-1-ol
PubChem CID54352391
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name3-(3,3-dimethylmorpholin-4-yl)propan-1-ol
SMILESCC1(C)COCCN1CCCO
InChIInChI=1S/C9H19NO2/c1-9(2)8-12-7-5-10(9)4-3-6-11/h11H,3-8H2,1-2H3
InChIKeyUGRMRDHEPJNRNE-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

4-(4-bromobutyl)-3,3-dimethylmorpholine
CID 61430684
3-[3-(methoxymethyl)-3-methylmorpholin-4-yl]propan-1-ol
CID 129320076
3-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpropan-1-amine
CID 61430784
3-(3,3-dimethylmorpholin-4-yl)propane-1-sulfonyl chloride
CID 112594686
4-[2-(1,3-dioxan-2-yl)ethyl]-3,3-dimethylmorpholine
CID 66472303
6-(3,3-dimethylmorpholin-4-yl)-3,3-dimethylhexan-1-amine
CID 65296338
5-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpentan-1-amine
CID 62461860
5-(3,3-dimethylmorpholin-4-yl)-N'-hydroxy-2,2-dimethylpentanimidamide
CID 77063786
3,3-dimethyl-4-(3-piperidin-4-ylpropyl)morpholine
CID 62212366
methyl 3-(3,3-dimethylmorpholin-4-yl)propanoate
CID 61433080
4-(3,3-dimethylmorpholin-4-yl)-N-(2-methoxyethyl)butan-1-amine
CID 62562752
(2S)-1-(3,3-dimethylmorpholin-4-yl)propan-2-ol
CID 103935066

Frequently Asked Questions

What is the IUPAC name of 3-(3,3-dimethylmorpholin-4-yl)propan-1-ol?
The IUPAC name of 3-(3,3-dimethylmorpholin-4-yl)propan-1-ol (CID 54352391) is 3-(3,3-dimethylmorpholin-4-yl)propan-1-ol.
What is the SMILES notation for 3-(3,3-dimethylmorpholin-4-yl)propan-1-ol?
The canonical SMILES for 3-(3,3-dimethylmorpholin-4-yl)propan-1-ol is CC1(C)COCCN1CCCO.
What is the InChIKey of 3-(3,3-dimethylmorpholin-4-yl)propan-1-ol?
The InChIKey is UGRMRDHEPJNRNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-9(2)8-12-7-5-10(9)4-3-6-11/h11H,3-8H2,1-2H3.
What are the key properties of 3-(3,3-dimethylmorpholin-4-yl)propan-1-ol?
3-(3,3-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-(3,3-dimethylmorpholin-4-yl)propan-1-ol is sourced from PubChem (CID 54352391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).