4-(cyclobutylmethyl)-3,3-dimethylmorpholine

C11H21NO — CID 127377423

IUPAC4-(cyclobutylmethyl)-3,3-dimethylmorpholine
SMILESCC1(C)COCCN1CC1CCC1
InChIInChI=1S/C11H21NO/c1-11(2)9-13-7-6-12(11)8-10-4-3-5-10/h10H,3-9H2,1-2H3
InChIKeyPCSTVSOQEKZGSF-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.90
Rot. Bonds2

About 4-(cyclobutylmethyl)-3,3-dimethylmorpholine

4-(cyclobutylmethyl)-3,3-dimethylmorpholine (PubChem CID 127377423) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 4-(cyclobutylmethyl)-3,3-dimethylmorpholine.

Molecular Properties

Compound Name4-(cyclobutylmethyl)-3,3-dimethylmorpholine
PubChem CID127377423
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name4-(cyclobutylmethyl)-3,3-dimethylmorpholine
SMILESCC1(C)COCCN1CC1CCC1
InChIInChI=1S/C11H21NO/c1-11(2)9-13-7-6-12(11)8-10-4-3-5-10/h10H,3-9H2,1-2H3
InChIKeyPCSTVSOQEKZGSF-UHFFFAOYSA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(3,3-dimethylmorpholin-4-yl)methyl]cyclopentan-1-amine
CID 66010292
3,3-dimethyl-4-(pyrrolidin-2-ylmethyl)morpholine
CID 61430451
3,3-dimethyl-4-[(2-methylpyrrolidin-3-yl)methyl]morpholine
CID 79384338
4-[2-(1,3-dioxan-2-yl)ethyl]-3,3-dimethylmorpholine
CID 66472303
3,3-dimethyl-4-(3-piperidin-4-ylpropyl)morpholine
CID 62212366
3-ethyl-3-methyl-4-(piperidin-3-ylmethyl)morpholine;hydrochloride
CID 120849148
3,3-dimethyl-4-(thiomorpholin-3-ylmethyl)morpholine
CID 82917179
2-(3,3-dimethylmorpholin-4-yl)cyclopentan-1-amine
CID 61429984
(2S)-1-(3,3-dimethylmorpholin-4-yl)propan-2-ol
CID 103935066
3-(3,3-dimethylmorpholin-4-yl)propan-1-ol
CID 54352391
2-methyl-5-[(1-methylpiperidin-4-yl)methyl]-8-oxa-5-azaspiro[3.5]nonane
CID 167009656
4-(4-bromobutyl)-3,3-dimethylmorpholine
CID 61430684

Frequently Asked Questions

What is the IUPAC name of 4-(cyclobutylmethyl)-3,3-dimethylmorpholine?
The IUPAC name of 4-(cyclobutylmethyl)-3,3-dimethylmorpholine (CID 127377423) is 4-(cyclobutylmethyl)-3,3-dimethylmorpholine.
What is the SMILES notation for 4-(cyclobutylmethyl)-3,3-dimethylmorpholine?
The canonical SMILES for 4-(cyclobutylmethyl)-3,3-dimethylmorpholine is CC1(C)COCCN1CC1CCC1.
What is the InChIKey of 4-(cyclobutylmethyl)-3,3-dimethylmorpholine?
The InChIKey is PCSTVSOQEKZGSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-11(2)9-13-7-6-12(11)8-10-4-3-5-10/h10H,3-9H2,1-2H3.
What are the key properties of 4-(cyclobutylmethyl)-3,3-dimethylmorpholine?
4-(cyclobutylmethyl)-3,3-dimethylmorpholine has a molecular weight of 183.29 g/mol, XLogP of 1.90, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclobutylmethyl)-3,3-dimethylmorpholine is sourced from PubChem (CID 127377423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).