N-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide

C16H22N2O3 — CID 114939986

IUPACN-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide
SMILESCC(C)CNC(=O)C(C)Oc1ccc2c(c1)NC(=O)CC2
InChIInChI=1S/C16H22N2O3/c1-10(2)9-17-16(20)11(3)21-13-6-4-12-5-7-15(19)18-14(12)8-13/h4,6,8,10-11H,5,7,9H2,1-3H3,(H,17,20)(H,18,19)
InChIKeyMIGARUAEVMCZFY-UHFFFAOYSA-N
MW290.36 g/mol
LogP2.11
Rot. Bonds5

About N-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide

N-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide (PubChem CID 114939986) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is N-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide.

Molecular Properties

Compound NameN-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide
PubChem CID114939986
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC NameN-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide
SMILESCC(C)CNC(=O)C(C)Oc1ccc2c(c1)NC(=O)CC2
InChIInChI=1S/C16H22N2O3/c1-10(2)9-17-16(20)11(3)21-13-6-4-12-5-7-15(19)18-14(12)8-13/h4,6,8,10-11H,5,7,9H2,1-3H3,(H,17,20)(H,18,19)
InChIKeyMIGARUAEVMCZFY-UHFFFAOYSA-N
XLogP2.11
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 52.11
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-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide?
The IUPAC name of N-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide (CID 114939986) is N-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide.
What is the SMILES notation for N-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide?
The canonical SMILES for N-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide is CC(C)CNC(=O)C(C)Oc1ccc2c(c1)NC(=O)CC2.
What is the InChIKey of N-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide?
The InChIKey is MIGARUAEVMCZFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-10(2)9-17-16(20)11(3)21-13-6-4-12-5-7-15(19)18-14(12)8-13/h4,6,8,10-11H,5,7,9H2,1-3H3,(H,17,20)(H,18,19).
What are the key properties of N-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide?
N-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide has a molecular weight of 290.36 g/mol, XLogP of 2.11, 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-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide is sourced from PubChem (CID 114939986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).