3-methoxy-N,N,2,3-tetramethylbutan-1-amine

C9H21NO — CID 54299795

IUPAC3-methoxy-N,N,2,3-tetramethylbutan-1-amine
SMILESCOC(C)(C)C(C)CN(C)C
InChIInChI=1S/C9H21NO/c1-8(7-10(4)5)9(2,3)11-6/h8H,7H2,1-6H3
InChIKeySDJYSWOMBHLLIE-UHFFFAOYSA-N
MW159.27 g/mol
LogP1.61
Rot. Bonds4

About 3-methoxy-N,N,2,3-tetramethylbutan-1-amine

3-methoxy-N,N,2,3-tetramethylbutan-1-amine (PubChem CID 54299795) has the molecular formula C9H21NO and a molecular weight of 159.27 g/mol. Its IUPAC name is 3-methoxy-N,N,2,3-tetramethylbutan-1-amine.

Molecular Properties

Compound Name3-methoxy-N,N,2,3-tetramethylbutan-1-amine
PubChem CID54299795
Molecular FormulaC9H21NO
Molecular Weight159.27 g/mol
Exact Mass159.16
IUPAC Name3-methoxy-N,N,2,3-tetramethylbutan-1-amine
SMILESCOC(C)(C)C(C)CN(C)C
InChIInChI=1S/C9H21NO/c1-8(7-10(4)5)9(2,3)11-6/h8H,7H2,1-6H3
InChIKeySDJYSWOMBHLLIE-UHFFFAOYSA-N
XLogP1.61
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.27
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(Dimethylamino)-2,3-dimethylbutan-2-ol
CID 13679424
CID 57568730
CID 57568730
CID 58881637
CID 58881637
2-(Methoxymethyl)butyl-trimethylazanium
CID 59940216
3-[4-(dimethylamino)-2,3-dimethylbutan-2-yl]oxy-N,N,2,3-tetramethylbutan-1-amine
CID 87390515
N,N,3-trimethyl-2-(propan-2-yloxymethyl)butan-1-amine
CID 89719379
2-(methoxymethyl)-N,N-dimethylbutan-1-amine
CID 118122887
N-methyl-N-[(2-methylpropan-2-yl)oxymethyl]butan-1-amine
CID 118973450
N-butyl-3-methoxy-3-methyl-N-propan-2-ylbutan-1-amine
CID 121474448
N,N-diethyl-3-methyl-3-(3-methylbutoxy)butan-1-amine
CID 123373731
N,2-dimethyl-N-[(2-methylpropan-2-yl)oxymethyl]propan-1-amine
CID 123482920
N-ethyl-N-(3-methoxypropyl)-2-methylbutan-1-amine
CID 124027648

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N,N,2,3-tetramethylbutan-1-amine?
The IUPAC name of 3-methoxy-N,N,2,3-tetramethylbutan-1-amine (CID 54299795) is 3-methoxy-N,N,2,3-tetramethylbutan-1-amine.
What is the SMILES notation for 3-methoxy-N,N,2,3-tetramethylbutan-1-amine?
The canonical SMILES for 3-methoxy-N,N,2,3-tetramethylbutan-1-amine is COC(C)(C)C(C)CN(C)C.
What is the InChIKey of 3-methoxy-N,N,2,3-tetramethylbutan-1-amine?
The InChIKey is SDJYSWOMBHLLIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO/c1-8(7-10(4)5)9(2,3)11-6/h8H,7H2,1-6H3.
What are the key properties of 3-methoxy-N,N,2,3-tetramethylbutan-1-amine?
3-methoxy-N,N,2,3-tetramethylbutan-1-amine has a molecular weight of 159.27 g/mol, XLogP of 1.61, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N,N,2,3-tetramethylbutan-1-amine is sourced from PubChem (CID 54299795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).