3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide

C15H17N3OS — CID 162353381

IUPAC3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide
SMILESO=C(CCN1CCCc2ccccc21)Nc1nccs1
InChIInChI=1S/C15H17N3OS/c19-14(17-15-16-8-11-20-15)7-10-18-9-3-5-12-4-1-2-6-13(12)18/h1-2,4,6,8,11H,3,5,7,9-10H2,(H,16,17,19)
InChIKeyRPQDEUULIGRPHF-UHFFFAOYSA-N
MW287.39 g/mol
LogP2.92
Rot. Bonds4

About 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide

3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide (PubChem CID 162353381) has the molecular formula C15H17N3OS and a molecular weight of 287.39 g/mol. Its IUPAC name is 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide
PubChem CID162353381
Molecular FormulaC15H17N3OS
Molecular Weight287.39 g/mol
Exact Mass287.11
IUPAC Name3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide
SMILESO=C(CCN1CCCc2ccccc21)Nc1nccs1
InChIInChI=1S/C15H17N3OS/c19-14(17-15-16-8-11-20-15)7-10-18-9-3-5-12-4-1-2-6-13(12)18/h1-2,4,6,8,11H,3,5,7,9-10H2,(H,16,17,19)
InChIKeyRPQDEUULIGRPHF-UHFFFAOYSA-N
XLogP2.92
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide?
The IUPAC name of 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide (CID 162353381) is 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide is O=C(CCN1CCCc2ccccc21)Nc1nccs1.
What is the InChIKey of 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide?
The InChIKey is RPQDEUULIGRPHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3OS/c19-14(17-15-16-8-11-20-15)7-10-18-9-3-5-12-4-1-2-6-13(12)18/h1-2,4,6,8,11H,3,5,7,9-10H2,(H,16,17,19).
What are the key properties of 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide?
3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide has a molecular weight of 287.39 g/mol, XLogP of 2.92, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 162353381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).