2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone

C23H18N4O — CID 109219565

IUPAC2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone
SMILESO=C(c1cc(Nc2cccc3cccnc23)ccn1)N1CCc2ccccc21
InChIInChI=1S/C23H18N4O/c28-23(27-14-11-16-5-1-2-9-21(16)27)20-15-18(10-13-24-20)26-19-8-3-6-17-7-4-12-25-22(17)19/h1-10,12-13,15H,11,14H2,(H,24,26)
InChIKeyBKWMCBHKJIBGKL-UHFFFAOYSA-N
MW366.42 g/mol
LogP4.58
Rot. Bonds3

About 2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone

2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone (PubChem CID 109219565) has the molecular formula C23H18N4O and a molecular weight of 366.42 g/mol. Its IUPAC name is 2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone.

Molecular Properties

Compound Name2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone
PubChem CID109219565
Molecular FormulaC23H18N4O
Molecular Weight366.42 g/mol
Exact Mass366.15
IUPAC Name2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone
SMILESO=C(c1cc(Nc2cccc3cccnc23)ccn1)N1CCc2ccccc21
InChIInChI=1S/C23H18N4O/c28-23(27-14-11-16-5-1-2-9-21(16)27)20-15-18(10-13-24-20)26-19-8-3-6-17-7-4-12-25-22(17)19/h1-10,12-13,15H,11,14H2,(H,24,26)
InChIKeyBKWMCBHKJIBGKL-UHFFFAOYSA-N
XLogP4.58
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dihydro-1H-isoquinolin-2-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone
CID 109213831
[4-(2-bromoanilino)-2-pyridinyl]-(2,3-dihydroindol-1-yl)methanone
CID 109219561
piperidin-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone
CID 109204521
2,3-dihydroindol-1-yl-(4-hydrazinyl-2-pyridinyl)methanone
CID 62249581
2,3-dihydroindol-1-yl-[4-(4-methoxyanilino)-2-pyridinyl]methanone
CID 109219537
2-[[2-(3,4-dihydro-2H-quinoline-1-carbonyl)-4-pyridinyl]amino]benzonitrile
CID 109219683
methyl 3-[[2-(2,3-dihydroindole-1-carbonyl)-4-pyridinyl]amino]benzoate
CID 109219554
[4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-pyridinyl]-(2,3-dihydroindol-1-yl)methanone
CID 109219564
4-[[2-(2,3-dihydroindole-1-carbonyl)-4-pyridinyl]amino]benzonitrile
CID 109219573
2,3-dihydroindol-1-yl-[4-(propan-2-ylamino)-2-pyridinyl]methanone
CID 109201577
[4-(2,6-difluoroanilino)-2-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109219687
2,3-dihydroindol-1-yl-[4-(2-methylpropylamino)-2-pyridinyl]methanone
CID 109203131

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone?
The IUPAC name of 2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone (CID 109219565) is 2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone.
What is the SMILES notation for 2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone?
The canonical SMILES for 2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone is O=C(c1cc(Nc2cccc3cccnc23)ccn1)N1CCc2ccccc21.
What is the InChIKey of 2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone?
The InChIKey is BKWMCBHKJIBGKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O/c28-23(27-14-11-16-5-1-2-9-21(16)27)20-15-18(10-13-24-20)26-19-8-3-6-17-7-4-12-25-22(17)19/h1-10,12-13,15H,11,14H2,(H,24,26).
What are the key properties of 2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone?
2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone has a molecular weight of 366.42 g/mol, XLogP of 4.58, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroindol-1-yl-[4-(quinolin-8-ylamino)-2-pyridinyl]methanone is sourced from PubChem (CID 109219565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).