3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide

C16H20N2O — CID 110486582

IUPAC3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide
SMILESCc1ccc2nc(CCC(=O)NC(C)C)ccc2c1
InChIInChI=1S/C16H20N2O/c1-11(2)17-16(19)9-7-14-6-5-13-10-12(3)4-8-15(13)18-14/h4-6,8,10-11H,7,9H2,1-3H3,(H,17,19)
InChIKeyJKFLPNYAEVZAGB-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.00
Rot. Bonds4

About 3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide

3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide (PubChem CID 110486582) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide
PubChem CID110486582
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide
SMILESCc1ccc2nc(CCC(=O)NC(C)C)ccc2c1
InChIInChI=1S/C16H20N2O/c1-11(2)17-16(19)9-7-14-6-5-13-10-12(3)4-8-15(13)18-14/h4-6,8,10-11H,7,9H2,1-3H3,(H,17,19)
InChIKeyJKFLPNYAEVZAGB-UHFFFAOYSA-N
XLogP3.00
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(6-fluoroquinolin-2-yl)-N-(2-methylpropyl)propanamide
CID 110465216
3-(6-fluoroquinolin-2-yl)-N-methylpropanamide
CID 110465204
2-[[2-(6-methylquinolin-2-yl)acetyl]amino]acetic acid
CID 110490348
N-(2-hydroxyethyl)-2-(6-methylquinolin-2-yl)acetamide
CID 110490351
3-(2-methyl-1,3-oxazol-4-yl)-N-propan-2-ylpropanamide
CID 110679159
N-butan-2-yl-3-(7-fluoroquinolin-2-yl)propanamide
CID 110486620
2-hexadecyl-6-methylquinoline
CID 4997368
2-(iodomethyl)-6-methylquinoline
CID 138975713
3-[1-(2,5-dimethylphenyl)ethylamino]-N-propan-2-ylpropanamide
CID 115579678
2,5-dimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 9299876
6-methyl-2-(nitromethyl)quinoline
CID 119082068
3-[(4,6-dimethyl-2-pyridinyl)methyl-methylamino]-N-propan-2-ylpropanamide
CID 91834164

Frequently Asked Questions

What is the IUPAC name of 3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide?
The IUPAC name of 3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide (CID 110486582) is 3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide?
The canonical SMILES for 3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide is Cc1ccc2nc(CCC(=O)NC(C)C)ccc2c1.
What is the InChIKey of 3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide?
The InChIKey is JKFLPNYAEVZAGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-11(2)17-16(19)9-7-14-6-5-13-10-12(3)4-8-15(13)18-14/h4-6,8,10-11H,7,9H2,1-3H3,(H,17,19).
What are the key properties of 3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide?
3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide has a molecular weight of 256.35 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methylquinolin-2-yl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 110486582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).