N-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide

C19H26N2O3 — CID 32919288

IUPACN-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide
SMILESCC1CCC(N(C)C(=O)COc2ccc3c(c2)CCC(=O)N3)CC1
InChIInChI=1S/C19H26N2O3/c1-13-3-6-15(7-4-13)21(2)19(23)12-24-16-8-9-17-14(11-16)5-10-18(22)20-17/h8-9,11,13,15H,3-7,10,12H2,1-2H3,(H,20,22)
InChIKeyPXKRBPKCAAPRBD-UHFFFAOYSA-N
MW330.43 g/mol
LogP2.99
Rot. Bonds4

About N-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide

N-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide (PubChem CID 32919288) has the molecular formula C19H26N2O3 and a molecular weight of 330.43 g/mol. Its IUPAC name is N-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide.

Molecular Properties

Compound NameN-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide
PubChem CID32919288
Molecular FormulaC19H26N2O3
Molecular Weight330.43 g/mol
Exact Mass330.19
IUPAC NameN-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide
SMILESCC1CCC(N(C)C(=O)COc2ccc3c(c2)CCC(=O)N3)CC1
InChIInChI=1S/C19H26N2O3/c1-13-3-6-15(7-4-13)21(2)19(23)12-24-16-8-9-17-14(11-16)5-10-18(22)20-17/h8-9,11,13,15H,3-7,10,12H2,1-2H3,(H,20,22)
InChIKeyPXKRBPKCAAPRBD-UHFFFAOYSA-N
XLogP2.99
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide?
The IUPAC name of N-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide (CID 32919288) is N-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide.
What is the SMILES notation for N-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide?
The canonical SMILES for N-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide is CC1CCC(N(C)C(=O)COc2ccc3c(c2)CCC(=O)N3)CC1.
What is the InChIKey of N-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide?
The InChIKey is PXKRBPKCAAPRBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3/c1-13-3-6-15(7-4-13)21(2)19(23)12-24-16-8-9-17-14(11-16)5-10-18(22)20-17/h8-9,11,13,15H,3-7,10,12H2,1-2H3,(H,20,22).
What are the key properties of N-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide?
N-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide has a molecular weight of 330.43 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(4-methylcyclohexyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)oxy]acetamide is sourced from PubChem (CID 32919288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).