3-(1-ethoxypropan-2-ylamino)pentan-1-ol

C10H23NO2 — CID 115723073

IUPAC3-(1-ethoxypropan-2-ylamino)pentan-1-ol
SMILESCCOCC(C)NC(CC)CCO
InChIInChI=1S/C10H23NO2/c1-4-10(6-7-12)11-9(3)8-13-5-2/h9-12H,4-8H2,1-3H3
InChIKeyIMUMRBVODPNGIU-UHFFFAOYSA-N
MW189.30 g/mol
LogP1.16
Rot. Bonds8

About 3-(1-ethoxypropan-2-ylamino)pentan-1-ol

3-(1-ethoxypropan-2-ylamino)pentan-1-ol (PubChem CID 115723073) has the molecular formula C10H23NO2 and a molecular weight of 189.30 g/mol. Its IUPAC name is 3-(1-ethoxypropan-2-ylamino)pentan-1-ol.

Molecular Properties

Compound Name3-(1-ethoxypropan-2-ylamino)pentan-1-ol
PubChem CID115723073
Molecular FormulaC10H23NO2
Molecular Weight189.30 g/mol
Exact Mass189.17
IUPAC Name3-(1-ethoxypropan-2-ylamino)pentan-1-ol
SMILESCCOCC(C)NC(CC)CCO
InChIInChI=1S/C10H23NO2/c1-4-10(6-7-12)11-9(3)8-13-5-2/h9-12H,4-8H2,1-3H3
InChIKeyIMUMRBVODPNGIU-UHFFFAOYSA-N
XLogP1.16
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-(1-ethoxypropan-2-ylamino)pentan-1-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(1-ethoxypropan-2-ylamino)pentan-1-ol?
The IUPAC name of 3-(1-ethoxypropan-2-ylamino)pentan-1-ol (CID 115723073) is 3-(1-ethoxypropan-2-ylamino)pentan-1-ol.
What is the SMILES notation for 3-(1-ethoxypropan-2-ylamino)pentan-1-ol?
The canonical SMILES for 3-(1-ethoxypropan-2-ylamino)pentan-1-ol is CCOCC(C)NC(CC)CCO.
What is the InChIKey of 3-(1-ethoxypropan-2-ylamino)pentan-1-ol?
The InChIKey is IMUMRBVODPNGIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO2/c1-4-10(6-7-12)11-9(3)8-13-5-2/h9-12H,4-8H2,1-3H3.
What are the key properties of 3-(1-ethoxypropan-2-ylamino)pentan-1-ol?
3-(1-ethoxypropan-2-ylamino)pentan-1-ol has a molecular weight of 189.30 g/mol, XLogP of 1.16, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethoxypropan-2-ylamino)pentan-1-ol is sourced from PubChem (CID 115723073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).