3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide

C16H22N2O2 — CID 65154594

IUPAC3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide
SMILESO=C(CCC1CCCO1)Nc1cccc2c1CCCN2
InChIInChI=1S/C16H22N2O2/c19-16(9-8-12-4-3-11-20-12)18-15-7-1-6-14-13(15)5-2-10-17-14/h1,6-7,12,17H,2-5,8-11H2,(H,18,19)
InChIKeyLXNODMKIQGQSPP-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.94
Rot. Bonds4

About 3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide

3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide (PubChem CID 65154594) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide.

Molecular Properties

Compound Name3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide
PubChem CID65154594
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide
SMILESO=C(CCC1CCCO1)Nc1cccc2c1CCCN2
InChIInChI=1S/C16H22N2O2/c19-16(9-8-12-4-3-11-20-12)18-15-7-1-6-14-13(15)5-2-10-17-14/h1,6-7,12,17H,2-5,8-11H2,(H,18,19)
InChIKeyLXNODMKIQGQSPP-UHFFFAOYSA-N
XLogP2.94
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cycloheptyl-N-(1,2,3,4-tetrahydroquinolin-5-yl)acetamide
CID 114457423
N-(2-chlorophenyl)-3-[(2R)-oxolan-2-yl]propanamide
CID 39087895
N-(3-chloro-2-methylphenyl)-3-(oxolan-2-yl)propanamide
CID 42956717
N-[2-methyl-3-[3-(oxolan-2-yl)propanoylamino]phenyl]benzamide
CID 87028458
N-tert-butyl-2-[3-[(2S)-oxolan-2-yl]propanoylamino]benzamide
CID 94642296
N-[2-(ethylaminomethyl)phenyl]-3-(oxolan-2-yl)propanamide
CID 65160577
3-[(2S)-oxolan-2-yl]-N-pyridin-2-ylpropanamide
CID 51938440
N-[2-(chloromethyl)phenyl]-3-(oxan-2-yl)propanamide
CID 114298345
4-hydroxy-3-[3-(oxolan-2-yl)propanoylamino]benzoic acid
CID 107264659
N-(2,5-dibromophenyl)-3-(oxolan-2-yl)propanamide
CID 55611657
1-propyl-3-(1,2,3,4-tetrahydroquinolin-5-yl)urea
CID 28786606
1,1-diethyl-3-(1,2,3,4-tetrahydroquinolin-5-yl)urea
CID 79161957

Frequently Asked Questions

What is the IUPAC name of 3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide?
The IUPAC name of 3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide (CID 65154594) is 3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide.
What is the SMILES notation for 3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide?
The canonical SMILES for 3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide is O=C(CCC1CCCO1)Nc1cccc2c1CCCN2.
What is the InChIKey of 3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide?
The InChIKey is LXNODMKIQGQSPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c19-16(9-8-12-4-3-11-20-12)18-15-7-1-6-14-13(15)5-2-10-17-14/h1,6-7,12,17H,2-5,8-11H2,(H,18,19).
What are the key properties of 3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide?
3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide has a molecular weight of 274.36 g/mol, XLogP of 2.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide is sourced from PubChem (CID 65154594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).