2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide

C15H18N2O — CID 18107936

IUPAC2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide
SMILESCc1ccc2nc(C)cc(C(=O)NC(C)C)c2c1
InChIInChI=1S/C15H18N2O/c1-9(2)16-15(18)13-8-11(4)17-14-6-5-10(3)7-12(13)14/h5-9H,1-4H3,(H,16,18)
InChIKeyKORMQVLVKODYBN-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.99
Rot. Bonds2

About 2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide

2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide (PubChem CID 18107936) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide.

Molecular Properties

Compound Name2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide
PubChem CID18107936
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide
SMILESCc1ccc2nc(C)cc(C(=O)NC(C)C)c2c1
InChIInChI=1S/C15H18N2O/c1-9(2)16-15(18)13-8-11(4)17-14-6-5-10(3)7-12(13)14/h5-9H,1-4H3,(H,16,18)
InChIKeyKORMQVLVKODYBN-UHFFFAOYSA-N
XLogP2.99
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-methoxypropan-2-yl)-2,6-dimethylquinoline-4-carboxamide
CID 18160978
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
2-(3,4-dimethylphenyl)-6-methyl-N-propan-2-ylquinoline-4-carboxamide
CID 42749696
2,6-dimethyl-N-[4-(2-methylpropanoylamino)phenyl]quinoline-4-carboxamide
CID 36556980
2-(2-fluorophenyl)-6-methyl-N-propan-2-ylquinoline-4-carboxamide
CID 42749910
2,6-dimethyl-N-(1-thiophen-3-ylpropan-2-yl)quinoline-4-carboxamide
CID 55974194
N-[2-(diethylamino)propyl]-2,6-dimethylquinoline-4-carboxamide
CID 55675834
2,6-dimethyl-N-(2-methylcyclohexyl)quinoline-4-carboxamide
CID 3184547
N-[3-(dimethylamino)-1-phenylpropyl]-2,6-dimethylquinoline-4-carboxamide
CID 70742212
2,6-dimethyl-N-[(1R)-1-(4-propyl-1,2,4-triazol-3-yl)ethyl]quinoline-4-carboxamide
CID 95129499
N-[(3S,4S)-4-methoxy-1-propan-2-ylpyrrolidin-3-yl]-2,6-dimethylquinoline-4-carboxamide
CID 70765038

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide?
The IUPAC name of 2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide (CID 18107936) is 2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide.
What is the SMILES notation for 2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide?
The canonical SMILES for 2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide is Cc1ccc2nc(C)cc(C(=O)NC(C)C)c2c1.
What is the InChIKey of 2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide?
The InChIKey is KORMQVLVKODYBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-9(2)16-15(18)13-8-11(4)17-14-6-5-10(3)7-12(13)14/h5-9H,1-4H3,(H,16,18).
What are the key properties of 2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide?
2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide has a molecular weight of 242.32 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-propan-2-ylquinoline-4-carboxamide is sourced from PubChem (CID 18107936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).