3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol

C11H23NO2 — CID 106206742

IUPAC3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol
SMILESCCCNC(CO)COCCC1CC1
InChIInChI=1S/C11H23NO2/c1-2-6-12-11(8-13)9-14-7-5-10-3-4-10/h10-13H,2-9H2,1H3
InChIKeyZKKIEANQIUBALG-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.16
Rot. Bonds9

About 3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol

3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol (PubChem CID 106206742) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol.

Molecular Properties

Compound Name3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol
PubChem CID106206742
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol
SMILESCCCNC(CO)COCCC1CC1
InChIInChI=1S/C11H23NO2/c1-2-6-12-11(8-13)9-14-7-5-10-3-4-10/h10-13H,2-9H2,1H3
InChIKeyZKKIEANQIUBALG-UHFFFAOYSA-N
XLogP1.16
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-(2-cyclopropylethoxy)-2-(propylamino)propan-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

Related Compounds

3-(cyclopropylmethoxy)-2-(propylamino)propan-1-ol
CID 64802807
3-propoxy-2-(propylamino)propan-1-ol
CID 64808128
3-(3,3-dimethylbutoxy)-2-(propylamino)propan-1-ol
CID 66227333
3-(2-cyclopropylethoxy)-2-(propylamino)propanoic acid
CID 106204336
3-(2-cyclobutylethoxy)-2-(propan-2-ylamino)propan-1-ol
CID 106206822
N-[1-cyclohexyl-2-(2-cyclopropylethoxy)ethyl]propan-1-amine
CID 114157400
6-(2-cyclobutylethoxy)-N-propylhexan-3-amine
CID 106201058
1-cyclohexyl-3-propoxy-N-propylpropan-2-amine
CID 62605609
N-[2-(2-cyclopropylethoxy)-1-(4-ethylphenyl)ethyl]propan-1-amine
CID 106200712
4-cyclohexyl-1-ethoxy-N-propylbutan-2-amine
CID 105008032
4-cyclopropyl-1-[(2-methylpropan-2-yl)oxy]-N-propylbutan-2-amine
CID 105157860
(2S)-1-(2-cyclopropylethoxy)propan-2-ol
CID 106203926

Frequently Asked Questions

What is the IUPAC name of 3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol?
The IUPAC name of 3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol (CID 106206742) is 3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol.
What is the SMILES notation for 3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol?
The canonical SMILES for 3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol is CCCNC(CO)COCCC1CC1.
What is the InChIKey of 3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol?
The InChIKey is ZKKIEANQIUBALG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-2-6-12-11(8-13)9-14-7-5-10-3-4-10/h10-13H,2-9H2,1H3.
What are the key properties of 3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol?
3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol has a molecular weight of 201.31 g/mol, XLogP of 1.16, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-cyclopropylethoxy)-2-(propylamino)propan-1-ol is sourced from PubChem (CID 106206742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).