N-ethyl-1-methoxy-N,2-dimethylpropan-1-amine

C8H19NO — CID 91571529

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

About N-ethyl-1-methoxy-N,2-dimethylpropan-1-amine

N-ethyl-1-methoxy-N,2-dimethylpropan-1-amine (PubChem CID 91571529) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is N-ethyl-1-methoxy-N,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-methoxy-N,2-dimethylpropan-1-amine
PubChem CID91571529
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC NameN-ethyl-1-methoxy-N,2-dimethylpropan-1-amine
SMILESCCN(C)C(OC)C(C)C
InChIInChI=1S/C8H19NO/c1-6-9(4)8(10-5)7(2)3/h7-8H,6H2,1-5H3
InChIKeyQCZNHLNLGUEKRS-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

US10214537, Example 170
CID 21026333
O-ethyl N,N-diisobutyl-thiocarbamate
CID 21542997
3-(difluoromethoxy)-N-ethyl-N,2-dimethylpropan-1-amine
CID 134269872
N-ethyl-3-(1-fluoropropoxy)-N,2-dimethylpropan-1-amine
CID 144384726
N-[3-(2-fluoroethoxy)propyl]-N,2-dimethylpropan-1-amine
CID 156802611
3-(difluoromethoxy)-N,N-diethyl-2-methylpropan-1-amine
CID 144384919
N-ethyl-3-(1-fluoroethoxy)-N,2-dimethylpropan-1-amine
CID 145580018
N,N-bis[(2-methylpropoxy)methyl]ethanamine
CID 21822625
3-methoxy-N,N,2,2-tetramethylpropan-1-amine
CID 345949
N-(ethoxymethyl)-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 12346639
N-butyl-N-(ethoxymethyl)butan-1-amine
CID 13285800
N-(ethoxymethyl)-N-propylpropan-1-amine
CID 13573568

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-methoxy-N,2-dimethylpropan-1-amine?
The IUPAC name of N-ethyl-1-methoxy-N,2-dimethylpropan-1-amine (CID 91571529) is N-ethyl-1-methoxy-N,2-dimethylpropan-1-amine.
What is the SMILES notation for N-ethyl-1-methoxy-N,2-dimethylpropan-1-amine?
The canonical SMILES for N-ethyl-1-methoxy-N,2-dimethylpropan-1-amine is CCN(C)C(OC)C(C)C.
What is the InChIKey of N-ethyl-1-methoxy-N,2-dimethylpropan-1-amine?
The InChIKey is QCZNHLNLGUEKRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-6-9(4)8(10-5)7(2)3/h7-8H,6H2,1-5H3.
What are the key properties of N-ethyl-1-methoxy-N,2-dimethylpropan-1-amine?
N-ethyl-1-methoxy-N,2-dimethylpropan-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 N-ethyl-1-methoxy-N,2-dimethylpropan-1-amine is sourced from PubChem (CID 91571529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).