4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine

C11H23NO3 — CID 58313495

IUPAC4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine
SMILESCOC1(C)CC(OC(C)C)OC(C)C1N
InChIInChI=1S/C11H23NO3/c1-7(2)14-9-6-11(4,13-5)10(12)8(3)15-9/h7-10H,6,12H2,1-5H3
InChIKeyNCPPTPVJAOIKIR-UHFFFAOYSA-N
MW217.31 g/mol
LogP1.28
Rot. Bonds3

About 4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine

4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine (PubChem CID 58313495) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is 4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine.

Molecular Properties

Compound Name4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine
PubChem CID58313495
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Name4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine
SMILESCOC1(C)CC(OC(C)C)OC(C)C1N
InChIInChI=1S/C11H23NO3/c1-7(2)14-9-6-11(4,13-5)10(12)8(3)15-9/h7-10H,6,12H2,1-5H3
InChIKeyNCPPTPVJAOIKIR-UHFFFAOYSA-N
XLogP1.28
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S,3R,4R,6S)-4-methoxy-2,4,6-trimethyloxan-3-amine
CID 134401507
(2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane
CID 89274647
[5-(dimethylamino)-3-ethyl-3,4-dihydroxyhexan-2-yl] 6-hydroxy-3-(5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-2,4-dimethyloctanoate
CID 143418001
trans-(1R,2S)-2-methyl-2-propan-2-yloxycyclopropan-1-amine
CID 125424211
2-methyl-2-propan-2-yloxycyclopropan-1-amine
CID 131476387
(2R,3S,4S,6S)-4-amino-6-methoxy-2,4-dimethyloxan-3-ol
CID 23254147
(2R,3R,4S,6S)-3-amino-6-methoxy-2-methyloxan-4-ol
CID 130909200
[(3R,4S)-4,5-dihydroxy-6-[[(2R,4R)-4-hydroxy-5-methoxy-2,4-dimethylpentyl]-methylamino]-4-methylheptan-3-yl] (3S,4R)-3-[(2R,4R,5S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-2,4-dimethylhexanoate
CID 143101221
5-methoxy-2-methyloxolan-3-amine
CID 163994899
2-propan-2-yloxyoxetane
CID 123446123
(2S,3R,5R,6R)-2-methyl-6-propan-2-yloxyoxane-3,5-diol
CID 130917816
(2R,4R,6S)-5-ethyl-4-methoxy-4,6-dimethyloxan-2-ol
CID 70252903

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine?
The IUPAC name of 4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine (CID 58313495) is 4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine.
What is the SMILES notation for 4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine?
The canonical SMILES for 4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine is COC1(C)CC(OC(C)C)OC(C)C1N.
What is the InChIKey of 4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine?
The InChIKey is NCPPTPVJAOIKIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-7(2)14-9-6-11(4,13-5)10(12)8(3)15-9/h7-10H,6,12H2,1-5H3.
What are the key properties of 4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine?
4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine has a molecular weight of 217.31 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2,4-dimethyl-6-propan-2-yloxyoxan-3-amine is sourced from PubChem (CID 58313495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).