3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one

C19H20FN3O — CID 56705728

IUPAC3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one
SMILESCCc1ccc(CN(C)Cc2cc3ccc(F)cc3[nH]c2=O)nc1
InChIInChI=1S/C19H20FN3O/c1-3-13-4-7-17(21-10-13)12-23(2)11-15-8-14-5-6-16(20)9-18(14)22-19(15)24/h4-10H,3,11-12H2,1-2H3,(H,22,24)
InChIKeyGIZIQOINGARAPG-UHFFFAOYSA-N
MW325.39 g/mol
LogP3.26
Rot. Bonds5

About 3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one

3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one (PubChem CID 56705728) has the molecular formula C19H20FN3O and a molecular weight of 325.39 g/mol. Its IUPAC name is 3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one.

Molecular Properties

Compound Name3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one
PubChem CID56705728
Molecular FormulaC19H20FN3O
Molecular Weight325.39 g/mol
Exact Mass325.16
IUPAC Name3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one
SMILESCCc1ccc(CN(C)Cc2cc3ccc(F)cc3[nH]c2=O)nc1
InChIInChI=1S/C19H20FN3O/c1-3-13-4-7-17(21-10-13)12-23(2)11-15-8-14-5-6-16(20)9-18(14)22-19(15)24/h4-10H,3,11-12H2,1-2H3,(H,22,24)
InChIKeyGIZIQOINGARAPG-UHFFFAOYSA-N
XLogP3.26
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-fluoro-3-[[methyl(2-pyridin-2-ylethyl)amino]methyl]-1H-quinolin-2-one
CID 56723183
7-methyl-3-[[methyl(pyridin-2-ylmethyl)amino]methyl]-1H-quinolin-2-one
CID 56721286
1-(5-ethyl-2-pyridinyl)-N-[(3-ethyl-1H-1,2,4-triazol-5-yl)methyl]-N-methylmethanamine
CID 91836205
(2R)-N-[(5-ethyl-2-pyridinyl)methyl]-2-(4-fluorophenyl)-2-hydroxy-N-methylacetamide
CID 99929265
N-[(5-ethyl-2-pyridinyl)methyl]-2-methoxy-N-methylethanamine
CID 90369559
3-[[(7-ethyl-2-oxochromen-4-yl)methylamino]methyl]-7-fluoro-1H-quinolin-2-one
CID 167938320
7-fluoro-3-[[(1-hydroxy-3-propan-2-yloxypropan-2-yl)-methylamino]methyl]-1H-quinolin-2-one
CID 167942598
2-(5-ethyl-2-pyridinyl)-1-(4-fluoro-2-methylphenyl)ethanone
CID 81273317
2-[(5-ethyl-2-pyridinyl)methyl]-5-fluorophenol
CID 83129957
[4-fluoro-2-[[(4-fluorophenyl)methyl-methylamino]methyl]phenyl]methanamine
CID 64769510
7-ethyl-3-hexyl-1H-quinolin-2-one
CID 70425300
N-[(5-ethyl-2-pyridinyl)methyl]-N-methyl-2,4-dioxo-1H-pyrimidine-5-carboxamide
CID 77081692

Frequently Asked Questions

What is the IUPAC name of 3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one?
The IUPAC name of 3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one (CID 56705728) is 3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one.
What is the SMILES notation for 3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one?
The canonical SMILES for 3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one is CCc1ccc(CN(C)Cc2cc3ccc(F)cc3[nH]c2=O)nc1.
What is the InChIKey of 3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one?
The InChIKey is GIZIQOINGARAPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN3O/c1-3-13-4-7-17(21-10-13)12-23(2)11-15-8-14-5-6-16(20)9-18(14)22-19(15)24/h4-10H,3,11-12H2,1-2H3,(H,22,24).
What are the key properties of 3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one?
3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one has a molecular weight of 325.39 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(5-ethyl-2-pyridinyl)methyl-methylamino]methyl]-7-fluoro-1H-quinolin-2-one is sourced from PubChem (CID 56705728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).