N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine

C11H25NO2 — CID 103033262

IUPACN-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine
SMILESCCOCC(C)NCCC(C)(C)OC
InChIInChI=1S/C11H25NO2/c1-6-14-9-10(2)12-8-7-11(3,4)13-5/h10,12H,6-9H2,1-5H3
InChIKeyPGWRQZHNZWKASU-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.82
Rot. Bonds8

About N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine

N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine (PubChem CID 103033262) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine.

Molecular Properties

Compound NameN-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine
PubChem CID103033262
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC NameN-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine
SMILESCCOCC(C)NCCC(C)(C)OC
InChIInChI=1S/C11H25NO2/c1-6-14-9-10(2)12-8-7-11(3,4)13-5/h10,12H,6-9H2,1-5H3
InChIKeyPGWRQZHNZWKASU-UHFFFAOYSA-N
XLogP1.82
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-methoxy-3-methylbutyl)amino]propan-1-ol
CID 103019922
1-ethoxy-N-ethyl-5-methoxy-5-methylhexan-2-amine
CID 103031120
2-N-(3-methoxy-3-methylbutyl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 103019955
5-chloro-N-(3-methoxy-3-methylbutyl)pentan-2-amine
CID 103037206
4-(1-ethoxypropan-2-ylamino)-N'-hydroxy-2,2-dimethylbutanimidamide
CID 77062756
N-(3,3-dimethylbutyl)-4-methoxy-4-methylpentan-2-amine
CID 115712795
4-chloro-N-(1-ethoxypropan-2-yl)-5-fluoro-3-methylpentan-1-amine
CID 146439046
6-(3-methoxy-3-methylbutoxy)-N-propylhexan-2-amine
CID 106665349
4-methoxy-4-methyl-N-(3,3,3-trifluoropropyl)pentan-2-amine
CID 63226548
1-ethoxy-N-[2-(2-methylpropoxy)ethyl]propan-2-amine
CID 115713728
N-(1,1-dimethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine
CID 106675441
1-N-cyclopropyl-2-N-(3-methoxy-3-methylbutyl)propane-1,2-diamine
CID 103019940

Frequently Asked Questions

What is the IUPAC name of N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine?
The IUPAC name of N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine (CID 103033262) is N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine.
What is the SMILES notation for N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine?
The canonical SMILES for N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine is CCOCC(C)NCCC(C)(C)OC.
What is the InChIKey of N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine?
The InChIKey is PGWRQZHNZWKASU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2/c1-6-14-9-10(2)12-8-7-11(3,4)13-5/h10,12H,6-9H2,1-5H3.
What are the key properties of N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine?
N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 1.82, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethoxypropan-2-yl)-3-methoxy-3-methylbutan-1-amine is sourced from PubChem (CID 103033262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).