N-ethyl-N-methoxy-2-methylbutan-1-amine

C8H19NO — CID 173403887

IUPACN-ethyl-N-methoxy-2-methylbutan-1-amine
SMILESCCC(C)CN(CC)OC
InChIInChI=1S/C8H19NO/c1-5-8(3)7-9(6-2)10-4/h8H,5-7H2,1-4H3
InChIKeyULTCNDDAEARLBF-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.92
Rot. Bonds5

About N-ethyl-N-methoxy-2-methylbutan-1-amine

N-ethyl-N-methoxy-2-methylbutan-1-amine (PubChem CID 173403887) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is N-ethyl-N-methoxy-2-methylbutan-1-amine.

Molecular Properties

Compound NameN-ethyl-N-methoxy-2-methylbutan-1-amine
PubChem CID173403887
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC NameN-ethyl-N-methoxy-2-methylbutan-1-amine
SMILESCCC(C)CN(CC)OC
InChIInChI=1S/C8H19NO/c1-5-8(3)7-9(6-2)10-4/h8H,5-7H2,1-4H3
InChIKeyULTCNDDAEARLBF-UHFFFAOYSA-N
XLogP1.92
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2S)-N-ethyl-N,2-dimethylbutan-1-amine
CID 89086806
N-butan-2-yl-2-methyl-N-propylbutan-1-amine
CID 176917771
ethane;N,N,2-trimethylbutan-1-amine
CID 144720352
N-methyl-N-(2-methylbutyl)hydroxylamine
CID 143701595
ethane;(2R)-N,N,2-trimethylbutan-1-amine
CID 178101295
carbanide;rutherfordium;N,N,2-trimethylbutan-1-amine
CID 166075746
N-(2-chloro-3-methoxypropyl)-N,2-dimethylbutan-1-amine
CID 63387954
2-methyl-N,N-bis(methylamino)butan-1-amine
CID 139482995
N-ethyl-N-methoxy-2-phosphanylethanamine
CID 87357434
2-[ethyl(2-methylbutyl)amino]ethanol
CID 62105905
2-methyl-N-(2-methylpropyl)-N-(1-trimethoxysilylpropyl)propan-1-amine
CID 87686623
N'-ethyl-N-(2-methoxyethyl)-N'-(2-methylbutyl)ethane-1,2-diamine
CID 79482433

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methoxy-2-methylbutan-1-amine?
The IUPAC name of N-ethyl-N-methoxy-2-methylbutan-1-amine (CID 173403887) is N-ethyl-N-methoxy-2-methylbutan-1-amine.
What is the SMILES notation for N-ethyl-N-methoxy-2-methylbutan-1-amine?
The canonical SMILES for N-ethyl-N-methoxy-2-methylbutan-1-amine is CCC(C)CN(CC)OC.
What is the InChIKey of N-ethyl-N-methoxy-2-methylbutan-1-amine?
The InChIKey is ULTCNDDAEARLBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-5-8(3)7-9(6-2)10-4/h8H,5-7H2,1-4H3.
What are the key properties of N-ethyl-N-methoxy-2-methylbutan-1-amine?
N-ethyl-N-methoxy-2-methylbutan-1-amine has a molecular weight of 145.25 g/mol, XLogP of 1.92, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methoxy-2-methylbutan-1-amine is sourced from PubChem (CID 173403887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).