4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine

C19H38N2O3 — CID 130178669

IUPAC4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine
SMILESCC1COCC(C)N1C(C)(C)COCC1COCCN1C(C)(C)C
InChIInChI=1S/C19H38N2O3/c1-15-10-23-11-16(2)21(15)19(6,7)14-24-13-17-12-22-9-8-20(17)18(3,4)5/h15-17H,8-14H2,1-7H3
InChIKeyODPTYHRSACXJSZ-UHFFFAOYSA-N
MW342.52 g/mol
LogP2.39
Rot. Bonds5

About 4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine

4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine (PubChem CID 130178669) has the molecular formula C19H38N2O3 and a molecular weight of 342.52 g/mol. Its IUPAC name is 4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine.

Molecular Properties

Compound Name4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine
PubChem CID130178669
Molecular FormulaC19H38N2O3
Molecular Weight342.52 g/mol
Exact Mass342.29
IUPAC Name4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine
SMILESCC1COCC(C)N1C(C)(C)COCC1COCCN1C(C)(C)C
InChIInChI=1S/C19H38N2O3/c1-15-10-23-11-16(2)21(15)19(6,7)14-24-13-17-12-22-9-8-20(17)18(3,4)5/h15-17H,8-14H2,1-7H3
InChIKeyODPTYHRSACXJSZ-UHFFFAOYSA-N
XLogP2.39
TPSA34.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.52
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine with MolForge

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Related Compounds

(3S)-4-tert-butyl-3-[(3-cyclobutyl-3-methylbutoxy)methyl]morpholine
CID 170416845
(3R)-3-methyl-4-(2-methylbutan-2-yl)morpholine
CID 170219937
3-(4-tert-butylmorpholin-3-yl)propanoic acid
CID 117009398
2-methyl-2-(3-methylmorpholin-4-yl)pentan-1-amine
CID 43541940
2,3-dimethyl-2-(3-methylmorpholin-4-yl)butan-1-amine
CID 61353365
(3R)-4-(1-tert-butylpiperidin-4-yl)-3-methylmorpholine
CID 118531607
methyl 2,2-dimethyl-3-(3-methylmorpholin-4-yl)propanoate
CID 79623724
(3R)-3-(2,2-dimethylpropyl)-4-methylmorpholine
CID 168851954
2-cyclopropyl-2-(3-methylmorpholin-4-yl)propanoic acid
CID 82236437
[3-methyl-1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine
CID 103562615
[1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine
CID 79521252
3,4-ditert-butyl-5-(methoxymethyl)morpholine
CID 153289782

Frequently Asked Questions

What is the IUPAC name of 4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine?
The IUPAC name of 4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine (CID 130178669) is 4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine.
What is the SMILES notation for 4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine?
The canonical SMILES for 4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine is CC1COCC(C)N1C(C)(C)COCC1COCCN1C(C)(C)C.
What is the InChIKey of 4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine?
The InChIKey is ODPTYHRSACXJSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N2O3/c1-15-10-23-11-16(2)21(15)19(6,7)14-24-13-17-12-22-9-8-20(17)18(3,4)5/h15-17H,8-14H2,1-7H3.
What are the key properties of 4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine?
4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine has a molecular weight of 342.52 g/mol, XLogP of 2.39, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[(4-tert-butylmorpholin-3-yl)methoxy]-2-methylpropan-2-yl]-3,5-dimethylmorpholine is sourced from PubChem (CID 130178669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).