2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine

C16H37NO — CID 167710729

IUPAC2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine
SMILESCC(C)CNCC(C)C.CC(C)COCC(C)C
InChIInChI=1S/C8H19N.C8H18O/c2*1-7(2)5-9-6-8(3)4/h7-9H,5-6H2,1-4H3;7-8H,5-6H2,1-4H3
InChIKeyZUMHOUVGIFWIIU-UHFFFAOYSA-N
MW259.48 g/mol
LogP4.20
Rot. Bonds8

About 2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine

2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine (PubChem CID 167710729) has the molecular formula C16H37NO and a molecular weight of 259.48 g/mol. Its IUPAC name is 2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine
PubChem CID167710729
Molecular FormulaC16H37NO
Molecular Weight259.48 g/mol
Exact Mass259.29
IUPAC Name2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine
SMILESCC(C)CNCC(C)C.CC(C)COCC(C)C
InChIInChI=1S/C8H19N.C8H18O/c2*1-7(2)5-9-6-8(3)4/h7-9H,5-6H2,1-4H3;7-8H,5-6H2,1-4H3
InChIKeyZUMHOUVGIFWIIU-UHFFFAOYSA-N
XLogP4.20
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.48
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 175939227
CID 175939227
2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride
CID 519535
methane;2-methyl-1-(2-methylpropoxy)propane
CID 162245040
2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]propan-1-amine
CID 106449858
1-[(3-methyl-2-propan-2-ylbutyl)amino]-3-(2-methylpropoxy)propan-2-ol
CID 102905545
1-(2-methylbutylamino)-3-(2-methylpropoxy)propan-2-ol
CID 62692862
ethanol;2-methyl-1-(2-methylpropoxy)propane
CID 23506368
N-(2-chloro-3-methoxypropyl)-2-methylpropan-1-amine
CID 65023756
2-methyl-N-(2-propan-2-yloxypropyl)propan-1-amine
CID 62444418
(2R)-1-(2-methylpropylamino)propan-2-ol
CID 777887
2-(ethoxymethyl)-N-(2-methylpropyl)pentan-1-amine
CID 103984246
1-(3-methylbutylamino)-3-(2-methylpropoxy)propan-2-ol
CID 60633825

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine?
The IUPAC name of 2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine (CID 167710729) is 2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine.
What is the SMILES notation for 2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine?
The canonical SMILES for 2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine is CC(C)CNCC(C)C.CC(C)COCC(C)C.
What is the InChIKey of 2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine?
The InChIKey is ZUMHOUVGIFWIIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N.C8H18O/c2*1-7(2)5-9-6-8(3)4/h7-9H,5-6H2,1-4H3;7-8H,5-6H2,1-4H3.
What are the key properties of 2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine?
2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine has a molecular weight of 259.48 g/mol, XLogP of 4.20, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine is sourced from PubChem (CID 167710729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).