1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine

C11H23NO3 — CID 103546950

IUPAC1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine
SMILESCCCNC(COCC)CC1OCCO1
InChIInChI=1S/C11H23NO3/c1-3-5-12-10(9-13-4-2)8-11-14-6-7-15-11/h10-12H,3-9H2,1-2H3
InChIKeyLCNMBPXAMPYNJB-UHFFFAOYSA-N
MW217.31 g/mol
LogP1.15
Rot. Bonds8

About 1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine

1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine (PubChem CID 103546950) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is 1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine.

Molecular Properties

Compound Name1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine
PubChem CID103546950
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Name1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine
SMILESCCCNC(COCC)CC1OCCO1
InChIInChI=1S/C11H23NO3/c1-3-5-12-10(9-13-4-2)8-11-14-6-7-15-11/h10-12H,3-9H2,1-2H3
InChIKeyLCNMBPXAMPYNJB-UHFFFAOYSA-N
XLogP1.15
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-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

1-(1,3-dioxolan-2-yl)-3-ethoxy-N-ethylpropan-2-amine
CID 103546949
1-(1,3-dioxolan-2-yl)-N-propylbutan-2-amine
CID 103546362
1-ethoxy-N-propylbutan-2-amine
CID 62040391
1-(1,3-dioxolan-2-yl)-5-methylsulfonyl-N-propylpentan-2-amine
CID 103546496
1-(1,3-dioxolan-2-yl)-N-propylbut-3-en-2-amine
CID 103546903
1-(1,3-dioxolan-2-yl)-3-ethyl-N-propylpentan-2-amine
CID 103546990
1-ethoxy-4-ethyl-N-propylhexan-2-amine
CID 82922255
1-(1,3-dioxolan-2-yl)-3-methyl-N-propylbut-3-en-2-amine
CID 103546934
1-(3,5-difluorophenyl)-3-(1,3-dioxolan-2-yl)-N-propylpropan-2-amine
CID 103547300
1-(1,3-dioxolan-2-yl)-4-phenyl-N-propylbutan-2-amine
CID 103546421
1-ethoxy-3-ethylsulfanyl-N-propylpropan-2-amine
CID 79574875
4-ethoxy-1-propoxy-N-propylbutan-2-amine
CID 112688262

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine?
The IUPAC name of 1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine (CID 103546950) is 1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine.
What is the SMILES notation for 1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine?
The canonical SMILES for 1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine is CCCNC(COCC)CC1OCCO1.
What is the InChIKey of 1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine?
The InChIKey is LCNMBPXAMPYNJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-3-5-12-10(9-13-4-2)8-11-14-6-7-15-11/h10-12H,3-9H2,1-2H3.
What are the key properties of 1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine?
1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine has a molecular weight of 217.31 g/mol, XLogP of 1.15, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dioxolan-2-yl)-3-ethoxy-N-propylpropan-2-amine is sourced from PubChem (CID 103546950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).