6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one

C19H21N3O4 — CID 57300767

IUPAC6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one
SMILESCOc1ccc(N2Cc3cnc(N)cc3C2=O)cc1OC1CCC(O)C1
InChIInChI=1S/C19H21N3O4/c1-25-16-5-2-12(6-17(16)26-14-4-3-13(23)7-14)22-10-11-9-21-18(20)8-15(11)19(22)24/h2,5-6,8-9,13-14,23H,3-4,7,10H2,1H3,(H2,20,21)
InChIKeyGRQXVIIVJTWFRK-UHFFFAOYSA-N
MW355.39 g/mol
LogP2.12
Rot. Bonds4

About 6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one

6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one (PubChem CID 57300767) has the molecular formula C19H21N3O4 and a molecular weight of 355.39 g/mol. Its IUPAC name is 6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one.

Molecular Properties

Compound Name6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one
PubChem CID57300767
Molecular FormulaC19H21N3O4
Molecular Weight355.39 g/mol
Exact Mass355.15
IUPAC Name6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one
SMILESCOc1ccc(N2Cc3cnc(N)cc3C2=O)cc1OC1CCC(O)C1
InChIInChI=1S/C19H21N3O4/c1-25-16-5-2-12(6-17(16)26-14-4-3-13(23)7-14)22-10-11-9-21-18(20)8-15(11)19(22)24/h2,5-6,8-9,13-14,23H,3-4,7,10H2,1H3,(H2,20,21)
InChIKeyGRQXVIIVJTWFRK-UHFFFAOYSA-N
XLogP2.12
TPSA97.91 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-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

6-amino-2-(3,4-dimethoxyphenyl)-3H-pyrrolo[3,4-c]pyridin-1-one
CID 57006155
6-amino-2-[1-[2-(3-cyclopentyloxy-4-methoxyphenyl)-3-oxo-1H-isoindol-5-yl]ethyl]-3H-pyrrolo[3,4-c]pyridin-1-one
CID 70166347
6-amino-2-(3,4-dimethoxyphenyl)-1H-pyrrolo[3,4-c]pyridin-3-one
CID 67669552
6-amino-2-(3-cyclopentyloxy-4-methoxyphenyl)-3-methyl-3H-pyrrolo[3,4-c]pyridin-1-one
CID 57148496
6-(3-cyclopentyloxy-4-methoxyphenyl)-7H-pyrrolo[3,4-b]pyridin-5-one
CID 67669438
2-[2-(3-cyclopentyloxy-4-methoxyphenyl)-3-oxo-1H-isoindole-5-carbonyl]pyrrolo[3,4-c]pyridine-1,3-dione
CID 142665297
2-[[2-(3-cyclopentyloxy-4-methoxyphenyl)-3-oxo-1H-isoindol-5-yl]amino]acetic acid;2-[[2-(3,4-dimethoxyphenyl)-3-oxo-1H-isoindol-5-yl]amino]acetic acid
CID 67671485
ethyl 2-[3-(cyclopentylmethoxy)-4-methoxyphenyl]-3-oxo-1H-isoindole-5-carboxylate
CID 173319566
2-(3-cyclopentyloxy-4-methoxyphenyl)-N-(1,3-dioxoisoindol-2-yl)-3-oxo-1H-isoindole-5-carboxamide
CID 142665259
3-(3-hydroxycyclopentyl)oxy-4-methoxybenzoyl azide
CID 57019519
2-[3-(2,3-dihydro-1H-inden-1-yloxy)-4-methoxyphenyl]-1,3-dihydropyrrolo[3,4-c]pyridin-6-amine
CID 67671503
2-[[2-[4-methoxy-3-(4-phenylbutan-2-yloxy)phenyl]-1-oxo-3H-pyrrolo[3,4-c]pyridin-6-yl]methyl]isoindole-1,3-dione
CID 142665254

Frequently Asked Questions

What is the IUPAC name of 6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one?
The IUPAC name of 6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one (CID 57300767) is 6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one.
What is the SMILES notation for 6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one?
The canonical SMILES for 6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one is COc1ccc(N2Cc3cnc(N)cc3C2=O)cc1OC1CCC(O)C1.
What is the InChIKey of 6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one?
The InChIKey is GRQXVIIVJTWFRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O4/c1-25-16-5-2-12(6-17(16)26-14-4-3-13(23)7-14)22-10-11-9-21-18(20)8-15(11)19(22)24/h2,5-6,8-9,13-14,23H,3-4,7,10H2,1H3,(H2,20,21).
What are the key properties of 6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one?
6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one has a molecular weight of 355.39 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-[3-(3-hydroxycyclopentyl)oxy-4-methoxyphenyl]-3H-pyrrolo[3,4-c]pyridin-1-one is sourced from PubChem (CID 57300767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).