N-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide

C16H24N2O2 — CID 107314025

IUPACN-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide
SMILESCC(C)CNC(=O)C(C)Oc1ccc2c(c1)NCCC2
InChIInChI=1S/C16H24N2O2/c1-11(2)10-18-16(19)12(3)20-14-7-6-13-5-4-8-17-15(13)9-14/h6-7,9,11-12,17H,4-5,8,10H2,1-3H3,(H,18,19)
InChIKeyCCYIWOWRRJMCAL-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.58
Rot. Bonds5

About N-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide

N-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide (PubChem CID 107314025) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide
PubChem CID107314025
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide
SMILESCC(C)CNC(=O)C(C)Oc1ccc2c(c1)NCCC2
InChIInChI=1S/C16H24N2O2/c1-11(2)10-18-16(19)12(3)20-14-7-6-13-5-4-8-17-15(13)9-14/h6-7,9,11-12,17H,4-5,8,10H2,1-3H3,(H,18,19)
InChIKeyCCYIWOWRRJMCAL-UHFFFAOYSA-N
XLogP2.58
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide?
The IUPAC name of N-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide (CID 107314025) is N-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide.
What is the SMILES notation for N-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide?
The canonical SMILES for N-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide is CC(C)CNC(=O)C(C)Oc1ccc2c(c1)NCCC2.
What is the InChIKey of N-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide?
The InChIKey is CCYIWOWRRJMCAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-11(2)10-18-16(19)12(3)20-14-7-6-13-5-4-8-17-15(13)9-14/h6-7,9,11-12,17H,4-5,8,10H2,1-3H3,(H,18,19).
What are the key properties of N-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide?
N-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide has a molecular weight of 276.38 g/mol, XLogP of 2.58, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-2-(1,2,3,4-tetrahydroquinolin-7-yloxy)propanamide is sourced from PubChem (CID 107314025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).