4-(5-hydroxypentylamino)-1-methylquinolin-2-one

C15H20N2O2 — CID 107318105

IUPAC4-(5-hydroxypentylamino)-1-methylquinolin-2-one
SMILESCn1c(=O)cc(NCCCCCO)c2ccccc21
InChIInChI=1S/C15H20N2O2/c1-17-14-8-4-3-7-12(14)13(11-15(17)19)16-9-5-2-6-10-18/h3-4,7-8,11,16,18H,2,5-6,9-10H2,1H3
InChIKeyDPXICGNIOGVKHO-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.11
Rot. Bonds6

About 4-(5-hydroxypentylamino)-1-methylquinolin-2-one

4-(5-hydroxypentylamino)-1-methylquinolin-2-one (PubChem CID 107318105) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 4-(5-hydroxypentylamino)-1-methylquinolin-2-one.

Molecular Properties

Compound Name4-(5-hydroxypentylamino)-1-methylquinolin-2-one
PubChem CID107318105
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name4-(5-hydroxypentylamino)-1-methylquinolin-2-one
SMILESCn1c(=O)cc(NCCCCCO)c2ccccc21
InChIInChI=1S/C15H20N2O2/c1-17-14-8-4-3-7-12(14)13(11-15(17)19)16-9-5-2-6-10-18/h3-4,7-8,11,16,18H,2,5-6,9-10H2,1H3
InChIKeyDPXICGNIOGVKHO-UHFFFAOYSA-N
XLogP2.11
TPSA54.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(butylamino)-1-methylquinolin-2-one
CID 81244865
3-[(1-methyl-2-oxoquinolin-4-yl)amino]propane-1-sulfonamide
CID 81243850
4-[(4-hydroxy-2-methylbutyl)amino]-1-methylquinolin-2-one
CID 81244421
1-methyl-4-(2-methylsulfonylethylamino)quinolin-2-one
CID 81244482
4-(3-aminobutylamino)-1-methylquinolin-2-one
CID 81237638
1-methyl-4-(pent-3-ynylamino)quinolin-2-one
CID 116644399
1-methyl-4-(2-piperazin-1-ylethylamino)quinolin-2-one
CID 81243681
1-methyl-4-[2-(3-methylbutoxy)ethylamino]quinolin-2-one
CID 81244191
1-methyl-4-[2-(2,2,2-trifluoroethoxy)ethylamino]quinolin-2-one
CID 81244474
6-amino-4-(2-hydroxyethylamino)-1-methylquinolin-2-one
CID 142478323
1-methyl-4-(oxolan-3-ylmethylamino)quinolin-2-one
CID 81244304
4-[[1-(hydroxymethyl)cyclopentyl]amino]-1-methylquinolin-2-one
CID 81243521

Frequently Asked Questions

What is the IUPAC name of 4-(5-hydroxypentylamino)-1-methylquinolin-2-one?
The IUPAC name of 4-(5-hydroxypentylamino)-1-methylquinolin-2-one (CID 107318105) is 4-(5-hydroxypentylamino)-1-methylquinolin-2-one.
What is the SMILES notation for 4-(5-hydroxypentylamino)-1-methylquinolin-2-one?
The canonical SMILES for 4-(5-hydroxypentylamino)-1-methylquinolin-2-one is Cn1c(=O)cc(NCCCCCO)c2ccccc21.
What is the InChIKey of 4-(5-hydroxypentylamino)-1-methylquinolin-2-one?
The InChIKey is DPXICGNIOGVKHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-17-14-8-4-3-7-12(14)13(11-15(17)19)16-9-5-2-6-10-18/h3-4,7-8,11,16,18H,2,5-6,9-10H2,1H3.
What are the key properties of 4-(5-hydroxypentylamino)-1-methylquinolin-2-one?
4-(5-hydroxypentylamino)-1-methylquinolin-2-one has a molecular weight of 260.34 g/mol, XLogP of 2.11, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-hydroxypentylamino)-1-methylquinolin-2-one is sourced from PubChem (CID 107318105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).