4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine

C13H29NO2 — CID 129037526

IUPAC4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine
SMILESCOCCC(C)(C)OCCC(C)(C)N(C)C
InChIInChI=1S/C13H29NO2/c1-12(2,14(5)6)8-11-16-13(3,4)9-10-15-7/h8-11H2,1-7H3
InChIKeyUCXVHGKESDZTRX-UHFFFAOYSA-N
MW231.38 g/mol
LogP2.55
Rot. Bonds8

About 4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine

4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine (PubChem CID 129037526) has the molecular formula C13H29NO2 and a molecular weight of 231.38 g/mol. Its IUPAC name is 4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine.

Molecular Properties

Compound Name4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine
PubChem CID129037526
Molecular FormulaC13H29NO2
Molecular Weight231.38 g/mol
Exact Mass231.22
IUPAC Name4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine
SMILESCOCCC(C)(C)OCCC(C)(C)N(C)C
InChIInChI=1S/C13H29NO2/c1-12(2,14(5)6)8-11-16-13(3,4)9-10-15-7/h8-11H2,1-7H3
InChIKeyUCXVHGKESDZTRX-UHFFFAOYSA-N
XLogP2.55
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine?
The IUPAC name of 4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine (CID 129037526) is 4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine.
What is the SMILES notation for 4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine?
The canonical SMILES for 4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine is COCCC(C)(C)OCCC(C)(C)N(C)C.
What is the InChIKey of 4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine?
The InChIKey is UCXVHGKESDZTRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NO2/c1-12(2,14(5)6)8-11-16-13(3,4)9-10-15-7/h8-11H2,1-7H3.
What are the key properties of 4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine?
4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine has a molecular weight of 231.38 g/mol, XLogP of 2.55, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxy-2-methylbutan-2-yl)oxy-N,N,2-trimethylbutan-2-amine is sourced from PubChem (CID 129037526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).