1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one

C14H18N2O — CID 82167951

IUPAC1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one
SMILESCc1cc(=O)n(CC(C)(C)N)c2ccccc12
InChIInChI=1S/C14H18N2O/c1-10-8-13(17)16(9-14(2,3)15)12-7-5-4-6-11(10)12/h4-8H,9,15H2,1-3H3
InChIKeyKCEAHSQYLOANTP-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.05
Rot. Bonds2

About 1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one

1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one (PubChem CID 82167951) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one.

Molecular Properties

Compound Name1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one
PubChem CID82167951
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one
SMILESCc1cc(=O)n(CC(C)(C)N)c2ccccc12
InChIInChI=1S/C14H18N2O/c1-10-8-13(17)16(9-14(2,3)15)12-7-5-4-6-11(10)12/h4-8H,9,15H2,1-3H3
InChIKeyKCEAHSQYLOANTP-UHFFFAOYSA-N
XLogP2.05
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-1-(3-oxobutyl)quinolin-2-one
CID 919960
1-(3-chlorobut-2-enyl)-4-methylquinolin-2-one
CID 3722733
methyl 2-(4-methyl-2-oxoquinolin-1-yl)acetate
CID 39767914
4-methyl-1-(2-oxo-2-pyrrolidin-1-ylethyl)quinolin-2-one
CID 39768041
4-methyl-1-[(4-nitrophenyl)methyl]quinolin-2-one
CID 39767911
ethyl 4,5-dimethyl-2-[[2-(4-methyl-2-oxoquinolin-1-yl)acetyl]amino]thiophene-3-carboxylate
CID 39767995
4-methyl-1-[4-(4-methylphenoxy)butyl]quinolin-2-one
CID 39768022
1-[2-(4-chlorophenoxy)ethyl]-4-methylquinolin-2-one
CID 39768066
3-(4-methyl-2-oxoquinolin-1-yl)-N-phenylpropanamide
CID 39763922
1-[(2-chloro-6-fluorophenyl)methyl]-4-methylquinolin-2-one
CID 39767907
N-(2-ethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
CID 39763926
1-[3-(4-chlorophenoxy)propyl]-4-methylquinolin-2-one
CID 39768018

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one?
The IUPAC name of 1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one (CID 82167951) is 1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one.
What is the SMILES notation for 1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one?
The canonical SMILES for 1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one is Cc1cc(=O)n(CC(C)(C)N)c2ccccc12.
What is the InChIKey of 1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one?
The InChIKey is KCEAHSQYLOANTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-10-8-13(17)16(9-14(2,3)15)12-7-5-4-6-11(10)12/h4-8H,9,15H2,1-3H3.
What are the key properties of 1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one?
1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one has a molecular weight of 230.31 g/mol, XLogP of 2.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-methylpropyl)-4-methylquinolin-2-one is sourced from PubChem (CID 82167951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).