5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline

C13H19NO — CID 142484620

IUPAC5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline
SMILESCCC(OC)c1cccc2c1CCCN2
InChIInChI=1S/C13H19NO/c1-3-13(15-2)11-6-4-8-12-10(11)7-5-9-14-12/h4,6,8,13-14H,3,5,7,9H2,1-2H3
InChIKeyLORARHPIXRNIKA-UHFFFAOYSA-N
MW205.30 g/mol
LogP3.14
Rot. Bonds3

About 5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline

5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline (PubChem CID 142484620) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline
PubChem CID142484620
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline
SMILESCCC(OC)c1cccc2c1CCCN2
InChIInChI=1S/C13H19NO/c1-3-13(15-2)11-6-4-8-12-10(11)7-5-9-14-12/h4,6,8,13-14H,3,5,7,9H2,1-2H3
InChIKeyLORARHPIXRNIKA-UHFFFAOYSA-N
XLogP3.14
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline 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 5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline (CID 142484620) is 5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline is CCC(OC)c1cccc2c1CCCN2.
What is the InChIKey of 5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline?
The InChIKey is LORARHPIXRNIKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-3-13(15-2)11-6-4-8-12-10(11)7-5-9-14-12/h4,6,8,13-14H,3,5,7,9H2,1-2H3.
What are the key properties of 5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline?
5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline has a molecular weight of 205.30 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methoxypropyl)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 142484620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).