N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide

C16H20N2O2 — CID 18160978

IUPACN-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide
SMILESCOCC(C)NC(=O)c1cc(C)nc2ccc(C)cc12
InChIInChI=1S/C16H20N2O2/c1-10-5-6-15-13(7-10)14(8-11(2)17-15)16(19)18-12(3)9-20-4/h5-8,12H,9H2,1-4H3,(H,18,19)
InChIKeyDIOUXSQOUNMILQ-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.62
Rot. Bonds4

About N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide

N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide (PubChem CID 18160978) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide
PubChem CID18160978
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide
SMILESCOCC(C)NC(=O)c1cc(C)nc2ccc(C)cc12
InChIInChI=1S/C16H20N2O2/c1-10-5-6-15-13(7-10)14(8-11(2)17-15)16(19)18-12(3)9-20-4/h5-8,12H,9H2,1-4H3,(H,18,19)
InChIKeyDIOUXSQOUNMILQ-UHFFFAOYSA-N
XLogP2.62
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide
CID 18107936
2,6-dimethyl-N-(1-thiophen-3-ylpropan-2-yl)quinoline-4-carboxamide
CID 55974194
N-[(1R,2S)-1-hydroxy-1-(4-methoxyphenyl)propan-2-yl]-2,6-dimethylquinoline-4-carboxamide
CID 97071689
N-[(1R,2R)-1-hydroxy-1-(4-methoxyphenyl)propan-2-yl]-2,6-dimethylquinoline-4-carboxamide
CID 97071690
N-(2-methoxyethyl)-2,6-dimethyl-N-pentan-3-ylquinoline-4-carboxamide
CID 55664290
6-bromo-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide
CID 46291474
N-(2-methoxyethyl)-6-methyl-2-phenylquinoline-4-carboxamide
CID 4795719
N-[2-(diethylamino)propyl]-2,6-dimethylquinoline-4-carboxamide
CID 55675834
6-amino-N-(2-methoxyethyl)-2-methylquinoline-4-carboxamide
CID 110489408
2,6-dimethyl-N-[4-(2-methylpropanoylamino)phenyl]quinoline-4-carboxamide
CID 36556980
2-methyl-N-(5-methylhexan-2-yl)quinoline-4-carboxamide
CID 4877911
2-(3,4-dimethylphenyl)-6-methyl-N-propan-2-ylquinoline-4-carboxamide
CID 42749696

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide?
The IUPAC name of N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide (CID 18160978) is N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide?
The canonical SMILES for N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide is COCC(C)NC(=O)c1cc(C)nc2ccc(C)cc12.
What is the InChIKey of N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide?
The InChIKey is DIOUXSQOUNMILQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-10-5-6-15-13(7-10)14(8-11(2)17-15)16(19)18-12(3)9-20-4/h5-8,12H,9H2,1-4H3,(H,18,19).
What are the key properties of N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide?
N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 2.62, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide is sourced from PubChem (CID 18160978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).