2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine

C13H29NO2 — CID 83044031

IUPAC2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine
SMILESCCCC(CNCC(C)C)OC(C)COC
InChIInChI=1S/C13H29NO2/c1-6-7-13(9-14-8-11(2)3)16-12(4)10-15-5/h11-14H,6-10H2,1-5H3
InChIKeyLJMAPSZHOYXKHG-UHFFFAOYSA-N
MW231.38 g/mol
LogP2.45
Rot. Bonds10

About 2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine

2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine (PubChem CID 83044031) has the molecular formula C13H29NO2 and a molecular weight of 231.38 g/mol. Its IUPAC name is 2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine.

Molecular Properties

Compound Name2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine
PubChem CID83044031
Molecular FormulaC13H29NO2
Molecular Weight231.38 g/mol
Exact Mass231.22
IUPAC Name2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine
SMILESCCCC(CNCC(C)C)OC(C)COC
InChIInChI=1S/C13H29NO2/c1-6-7-13(9-14-8-11(2)3)16-12(4)10-15-5/h11-14H,6-10H2,1-5H3
InChIKeyLJMAPSZHOYXKHG-UHFFFAOYSA-N
XLogP2.45
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-2-(1-methoxypropan-2-yloxy)pentan-1-amine
CID 83044032
2-(3-methylbut-3-enoxy)-N-(2-methylpropyl)pentan-1-amine
CID 114470650
2-octan-2-yloxy-N-propylpentan-1-amine
CID 83046068
2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-N-(2-methylpropyl)pentan-1-amine
CID 104566397
2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride
CID 519535
N-[2-[2-(diethylamino)ethoxy]-3-methoxypropyl]-2-methylpropan-1-amine
CID 103228309
N-(2-chloro-3-methoxypropyl)-2-methylpropan-1-amine
CID 65023756
2-(ethoxymethyl)-N-(2-methylpropyl)pentan-1-amine
CID 103984246
CID 175939227
CID 175939227
1,2-dimethoxypentane
CID 22961171
N-(2-butan-2-yloxypropyl)-2-methylpropan-1-amine
CID 62453630
2-methyl-N-(2-methylpropyl)-4-propoxybutan-1-amine
CID 79568932

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine?
The IUPAC name of 2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine (CID 83044031) is 2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine.
What is the SMILES notation for 2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine?
The canonical SMILES for 2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine is CCCC(CNCC(C)C)OC(C)COC.
What is the InChIKey of 2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine?
The InChIKey is LJMAPSZHOYXKHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NO2/c1-6-7-13(9-14-8-11(2)3)16-12(4)10-15-5/h11-14H,6-10H2,1-5H3.
What are the key properties of 2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine?
2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine has a molecular weight of 231.38 g/mol, XLogP of 2.45, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxypropan-2-yloxy)-N-(2-methylpropyl)pentan-1-amine is sourced from PubChem (CID 83044031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).