2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone

C20H15N5O — CID 100728066

IUPAC2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone
SMILESO=C(c1ncccc1-n1ncc2ccccc21)N1CCc2cnccc21
InChIInChI=1S/C20H15N5O/c26-20(24-11-8-15-12-21-10-7-16(15)24)19-18(6-3-9-22-19)25-17-5-2-1-4-14(17)13-23-25/h1-7,9-10,12-13H,8,11H2
InChIKeyHYQPUMMLVZNLNZ-UHFFFAOYSA-N
MW341.37 g/mol
LogP3.02
Rot. Bonds2

About 2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone

2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone (PubChem CID 100728066) has the molecular formula C20H15N5O and a molecular weight of 341.37 g/mol. Its IUPAC name is 2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone.

Molecular Properties

Compound Name2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone
PubChem CID100728066
Molecular FormulaC20H15N5O
Molecular Weight341.37 g/mol
Exact Mass341.13
IUPAC Name2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone
SMILESO=C(c1ncccc1-n1ncc2ccccc21)N1CCc2cnccc21
InChIInChI=1S/C20H15N5O/c26-20(24-11-8-15-12-21-10-7-16(15)24)19-18(6-3-9-22-19)25-17-5-2-1-4-14(17)13-23-25/h1-7,9-10,12-13H,8,11H2
InChIKeyHYQPUMMLVZNLNZ-UHFFFAOYSA-N
XLogP3.02
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone with MolForge

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Related Compounds

(3-bromo-2-pyridinyl)-(2,3-dihydroindol-1-yl)methanone
CID 107517784
1-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)ethanone
CID 45086257
(3-chloro-4-pyridinyl)-(2,3-dihydroindol-1-yl)methanone
CID 66462242
1-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)-3-hydroxypropan-1-one
CID 142479905
2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-pyrrol-1-ylthiophen-2-yl)methanone
CID 75510227
[2-(3,4-difluorophenyl)-1,3-thiazol-5-yl]-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)methanone
CID 99715528
2,3-dihydroindol-1-yl-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]methanone
CID 25466745
2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(7-fluoroquinoxalin-5-yl)methanone
CID 75520175
tert-butyl 2,3-dihydropyrrolo[3,2-c]pyridine-1-carboxylate
CID 11020412
3-indazol-1-yl-2-methylbenzoic acid
CID 19744370
2,2-dicyclopropyl-1-(2,3-dihydropyrrolo[3,2-c]pyridin-1-yl)ethanone
CID 75502685
(4-chloro-3-pyridinyl)-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 81226103

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone?
The IUPAC name of 2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone (CID 100728066) is 2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone.
What is the SMILES notation for 2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone?
The canonical SMILES for 2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone is O=C(c1ncccc1-n1ncc2ccccc21)N1CCc2cnccc21.
What is the InChIKey of 2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone?
The InChIKey is HYQPUMMLVZNLNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5O/c26-20(24-11-8-15-12-21-10-7-16(15)24)19-18(6-3-9-22-19)25-17-5-2-1-4-14(17)13-23-25/h1-7,9-10,12-13H,8,11H2.
What are the key properties of 2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone?
2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone has a molecular weight of 341.37 g/mol, XLogP of 3.02, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydropyrrolo[3,2-c]pyridin-1-yl-(3-indazol-1-yl-2-pyridinyl)methanone is sourced from PubChem (CID 100728066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).