1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine

C13H29NO2 — CID 103487691

IUPAC1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine
SMILESCCNC(COC(C)COCC)C(C)CC
InChIInChI=1S/C13H29NO2/c1-6-11(4)13(14-7-2)10-16-12(5)9-15-8-3/h11-14H,6-10H2,1-5H3
InChIKeyQYDZSNGTKCJETC-UHFFFAOYSA-N
MW231.38 g/mol
LogP2.45
Rot. Bonds10

About 1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine

1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine (PubChem CID 103487691) has the molecular formula C13H29NO2 and a molecular weight of 231.38 g/mol. Its IUPAC name is 1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine.

Molecular Properties

Compound Name1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine
PubChem CID103487691
Molecular FormulaC13H29NO2
Molecular Weight231.38 g/mol
Exact Mass231.22
IUPAC Name1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine
SMILESCCNC(COC(C)COCC)C(C)CC
InChIInChI=1S/C13H29NO2/c1-6-11(4)13(14-7-2)10-16-12(5)9-15-8-3/h11-14H,6-10H2,1-5H3
InChIKeyQYDZSNGTKCJETC-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

Analyze 1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-1,2-diethoxypropane
CID 92973991
methyl 3-(1-ethoxypropan-2-yloxy)-2-(ethylamino)propanoate
CID 103489799
4-(1-ethoxypropan-2-yloxy)-2-(ethylamino)butanenitrile
CID 103489740
N-ethyl-2,5-dimethylheptan-4-amine
CID 63717421
2-N-ethyl-3-methylpentane-1,2-diamine
CID 62066397
1-ethoxy-2-(2-ethoxypropoxy)propane;1-ethoxy-2-(2-methoxypropoxy)propane
CID 159210596
1-(2-ethoxyphenyl)-2-(1-ethoxypropan-2-yloxy)-N-ethylethanamine
CID 103487528
(2S,3S)-3-N-ethenyl-1-ethoxy-2-N-ethyl-3-N-methylbutane-2,3-diamine
CID 138599680
N-ethyl-3,6-dimethyloctan-4-amine
CID 63717606
2-ethoxy-1-(2-ethoxypropoxy)propane
CID 21277912
ethyl 3-(1-ethoxypropan-2-yloxy)-2-(methylamino)propanoate
CID 103489818
1-(2,2-difluoroethoxy)-N-ethyl-4-methylhexan-3-amine
CID 103149557

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine?
The IUPAC name of 1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine (CID 103487691) is 1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine.
What is the SMILES notation for 1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine?
The canonical SMILES for 1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine is CCNC(COC(C)COCC)C(C)CC.
What is the InChIKey of 1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine?
The InChIKey is QYDZSNGTKCJETC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NO2/c1-6-11(4)13(14-7-2)10-16-12(5)9-15-8-3/h11-14H,6-10H2,1-5H3.
What are the key properties of 1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine?
1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-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 1-(1-ethoxypropan-2-yloxy)-N-ethyl-3-methylpentan-2-amine is sourced from PubChem (CID 103487691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).