N-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide

C20H26N2O3 — CID 124754627

IUPACN-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide
SMILESCc1[nH]c2ccccc2c(=O)c1CCC(=O)N(C)C[C@H]1CCCCO1
InChIInChI=1S/C20H26N2O3/c1-14-16(20(24)17-8-3-4-9-18(17)21-14)10-11-19(23)22(2)13-15-7-5-6-12-25-15/h3-4,8-9,15H,5-7,10-13H2,1-2H3,(H,21,24)/t15-/m1/s1
InChIKeyOLPJFGYCBFXTAH-OAHLLOKOSA-N
MW342.44 g/mol
LogP2.80
Rot. Bonds5

About N-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide

N-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide (PubChem CID 124754627) has the molecular formula C20H26N2O3 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide.

Molecular Properties

Compound NameN-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide
PubChem CID124754627
Molecular FormulaC20H26N2O3
Molecular Weight342.44 g/mol
Exact Mass342.19
IUPAC NameN-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide
SMILESCc1[nH]c2ccccc2c(=O)c1CCC(=O)N(C)C[C@H]1CCCCO1
InChIInChI=1S/C20H26N2O3/c1-14-16(20(24)17-8-3-4-9-18(17)21-14)10-11-19(23)22(2)13-15-7-5-6-12-25-15/h3-4,8-9,15H,5-7,10-13H2,1-2H3,(H,21,24)/t15-/m1/s1
InChIKeyOLPJFGYCBFXTAH-OAHLLOKOSA-N
XLogP2.80
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide with MolForge

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Related Compounds

3-[5-[2-(1H-indol-3-yl)ethyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-[[(2R)-oxan-2-yl]methyl]propanamide
CID 42564953
3-[5-[2-(1H-indol-3-yl)ethyl]-1,3,4-oxadiazol-2-yl]-N-methyl-N-(oxan-2-ylmethyl)propanamide
CID 45218078
3-(3-aminophenyl)-N-methyl-N-(oxan-2-ylmethyl)propanamide
CID 61436237
N-[(3S,4R)-3-methoxyoxan-4-yl]-3-(2-methyl-4-oxo-1H-quinolin-3-yl)propanamide
CID 91795462
3-[3-[(2S)-2-(2-methoxyethyl)morpholin-4-yl]-3-oxopropyl]-2-methyl-1H-quinolin-4-one
CID 124755147
N-methyl-N-(oxan-2-ylmethyl)-2-(1-oxoisoquinolin-2-yl)acetamide
CID 72938624
1-(2-methyl-1H-indol-3-yl)-3-(oxolan-2-yl)propan-1-one
CID 65154773
3-[3-[(6S)-6-[(dimethylamino)methyl]-1,4-oxazepan-4-yl]-3-oxopropyl]-2-methyl-1H-quinolin-4-one
CID 124752091
4-[3-[methyl-[[(2R)-oxolan-2-yl]methyl]amino]-3-oxopropyl]benzoic acid
CID 124686880
N-methyl-N-[[(2R)-oxan-2-yl]methyl]-2-[2-(trifluoromethyl)phenyl]acetamide
CID 124536730
N-methyl-4-(methylamino)-N-(oxan-2-ylmethyl)butanamide
CID 61436258
3-[[benzyl(methyl)carbamoyl]amino]-N-methyl-N-[[(2S)-oxan-2-yl]methyl]propanamide
CID 96998499

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide?
The IUPAC name of N-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide (CID 124754627) is N-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide.
What is the SMILES notation for N-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide?
The canonical SMILES for N-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide is Cc1[nH]c2ccccc2c(=O)c1CCC(=O)N(C)C[C@H]1CCCCO1.
What is the InChIKey of N-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide?
The InChIKey is OLPJFGYCBFXTAH-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H26N2O3/c1-14-16(20(24)17-8-3-4-9-18(17)21-14)10-11-19(23)22(2)13-15-7-5-6-12-25-15/h3-4,8-9,15H,5-7,10-13H2,1-2H3,(H,21,24)/t15-/m1/s1.
What are the key properties of N-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide?
N-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide has a molecular weight of 342.44 g/mol, XLogP of 2.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(2-methyl-4-oxo-1H-quinolin-3-yl)-N-[[(2R)-oxan-2-yl]methyl]propanamide is sourced from PubChem (CID 124754627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).