6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one

C15H14FN3O2 — CID 43206333

IUPAC6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one
SMILESCOc1ccc(CNC2C(=O)Nc3cc(F)ccc32)cn1
InChIInChI=1S/C15H14FN3O2/c1-21-13-5-2-9(7-17-13)8-18-14-11-4-3-10(16)6-12(11)19-15(14)20/h2-7,14,18H,8H2,1H3,(H,19,20)
InChIKeyDZDJSEXXYGMMHH-UHFFFAOYSA-N
MW287.29 g/mol
LogP2.01
Rot. Bonds4

About 6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one

6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one (PubChem CID 43206333) has the molecular formula C15H14FN3O2 and a molecular weight of 287.29 g/mol. Its IUPAC name is 6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one
PubChem CID43206333
Molecular FormulaC15H14FN3O2
Molecular Weight287.29 g/mol
Exact Mass287.11
IUPAC Name6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one
SMILESCOc1ccc(CNC2C(=O)Nc3cc(F)ccc32)cn1
InChIInChI=1S/C15H14FN3O2/c1-21-13-5-2-9(7-17-13)8-18-14-11-4-3-10(16)6-12(11)19-15(14)20/h2-7,14,18H,8H2,1H3,(H,19,20)
InChIKeyDZDJSEXXYGMMHH-UHFFFAOYSA-N
XLogP2.01
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.29
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-bromo-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one
CID 43206349
1-[(4-fluorophenyl)methyl]-3-[(6-methoxy-3-pyridinyl)methyl]urea
CID 51324930
6-fluoro-3-(furan-2-ylmethylamino)-1,3-dihydroindol-2-one
CID 16771645
3-[(6-methoxy-3-pyridinyl)methylamino]piperidine-2,6-dione
CID 114936796
5-fluoro-3-[(3-methylphenyl)methylamino]-1,3-dihydroindol-2-one
CID 43204421
1-[(4R)-6-fluoro-3,4-dihydro-2H-thiochromen-4-yl]-3-[(6-methoxy-3-pyridinyl)methyl]urea
CID 94039689
2,4-difluoro-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 47136619
2,5-difluoro-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 47136692
2-ethoxy-4-fluoro-N-[(6-methoxy-3-pyridinyl)methyl]aniline
CID 114936544
2-amino-5-fluoro-N-[(6-methoxy-3-pyridinyl)methyl]benzenesulfonamide
CID 62990585
N-[(6-methoxy-3-pyridinyl)methyl]-2-methylcyclopropan-1-amine
CID 114936732
2-[(6-fluoro-2-oxo-1,3-dihydroindol-3-yl)amino]-N-propan-2-ylacetamide
CID 43567793

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one?
The IUPAC name of 6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one (CID 43206333) is 6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one?
The canonical SMILES for 6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one is COc1ccc(CNC2C(=O)Nc3cc(F)ccc32)cn1.
What is the InChIKey of 6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one?
The InChIKey is DZDJSEXXYGMMHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O2/c1-21-13-5-2-9(7-17-13)8-18-14-11-4-3-10(16)6-12(11)19-15(14)20/h2-7,14,18H,8H2,1H3,(H,19,20).
What are the key properties of 6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one?
6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one has a molecular weight of 287.29 g/mol, XLogP of 2.01, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-[(6-methoxy-3-pyridinyl)methylamino]-1,3-dihydroindol-2-one is sourced from PubChem (CID 43206333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).