1-methoxy-N,N,2-trimethylbutan-1-amine

C8H19NO — CID 91572935

IUPAC1-methoxy-N,N,2-trimethylbutan-1-amine
SMILESCCC(C)C(OC)N(C)C
InChIInChI=1S/C8H19NO/c1-6-7(2)8(10-5)9(3)4/h7-8H,6H2,1-5H3
InChIKeyHDFKRXZGVSUKKH-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.57
Rot. Bonds4

About 1-methoxy-N,N,2-trimethylbutan-1-amine

1-methoxy-N,N,2-trimethylbutan-1-amine (PubChem CID 91572935) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is 1-methoxy-N,N,2-trimethylbutan-1-amine.

Molecular Properties

Compound Name1-methoxy-N,N,2-trimethylbutan-1-amine
PubChem CID91572935
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name1-methoxy-N,N,2-trimethylbutan-1-amine
SMILESCCC(C)C(OC)N(C)C
InChIInChI=1S/C8H19NO/c1-6-7(2)8(10-5)9(3)4/h7-8H,6H2,1-5H3
InChIKeyHDFKRXZGVSUKKH-UHFFFAOYSA-N
XLogP1.57
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1,2-dimethoxy-N,N,4-trimethylpentan-1-amine
CID 87595068
(3R,4R)-3,4-dimethylhexane;methane
CID 159261482
(2S)-N-ethyl-2-methoxy-N,3-dimethylpentan-3-amine
CID 146347194
(1R)-1-methoxy-2-methylbutan-1-ol
CID 88580756
(2R)-N,N,2,3-tetramethylpentan-1-amine
CID 130182039
(1S)-1-methoxy-N,N-dimethylethanamine
CID 89341126
N-(2,2-dimethoxyethyl)-N-methylbutan-2-amine
CID 66223820
3-methylheptan-4-ylphosphane
CID 178108210
N-ethyl-N,3-dimethylpentan-2-amine
CID 89053898
(4R)-3-ethyl-4-methylhexane
CID 59954491
butan-2-ylphosphane;hydrochloride
CID 174764071
CID 91437014
CID 91437014

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N,N,2-trimethylbutan-1-amine?
The IUPAC name of 1-methoxy-N,N,2-trimethylbutan-1-amine (CID 91572935) is 1-methoxy-N,N,2-trimethylbutan-1-amine.
What is the SMILES notation for 1-methoxy-N,N,2-trimethylbutan-1-amine?
The canonical SMILES for 1-methoxy-N,N,2-trimethylbutan-1-amine is CCC(C)C(OC)N(C)C.
What is the InChIKey of 1-methoxy-N,N,2-trimethylbutan-1-amine?
The InChIKey is HDFKRXZGVSUKKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-6-7(2)8(10-5)9(3)4/h7-8H,6H2,1-5H3.
What are the key properties of 1-methoxy-N,N,2-trimethylbutan-1-amine?
1-methoxy-N,N,2-trimethylbutan-1-amine has a molecular weight of 145.25 g/mol, XLogP of 1.57, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N,N,2-trimethylbutan-1-amine is sourced from PubChem (CID 91572935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).