(2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone

C19H19N3O2 — CID 84580016

IUPAC(2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone
SMILESO=C(c1ccccc1O)N1CCC(c2c[nH]c3cccnc23)CC1
InChIInChI=1S/C19H19N3O2/c23-17-6-2-1-4-14(17)19(24)22-10-7-13(8-11-22)15-12-21-16-5-3-9-20-18(15)16/h1-6,9,12-13,21,23H,7-8,10-11H2
InChIKeyQISNSXATHGOWRM-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.29
Rot. Bonds2

About (2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone

(2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone (PubChem CID 84580016) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is (2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone
PubChem CID84580016
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC Name(2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone
SMILESO=C(c1ccccc1O)N1CCC(c2c[nH]c3cccnc23)CC1
InChIInChI=1S/C19H19N3O2/c23-17-6-2-1-4-14(17)19(24)22-10-7-13(8-11-22)15-12-21-16-5-3-9-20-18(15)16/h1-6,9,12-13,21,23H,7-8,10-11H2
InChIKeyQISNSXATHGOWRM-UHFFFAOYSA-N
XLogP3.29
TPSA69.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone with MolForge

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Related Compounds

(3-bromophenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone
CID 110476889
(5-chloro-2-methoxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone
CID 84579932
[4-(1H-indol-3-yl)piperidin-1-yl]-(2-phenoxy-3-pyridinyl)methanone
CID 24646101
[4-(1H-indol-3-yl)piperidin-1-yl]-pyridin-2-ylmethanone
CID 122190657
2-(3-chlorophenyl)-1-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]ethanone
CID 112533822
[4-(1H-indol-3-yl)piperidin-1-yl]-(2-methylphenyl)methanone
CID 84559294
3-(3-methoxyphenyl)-1-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]propan-1-one
CID 112533887
[4-(1H-indol-3-yl)piperidin-1-yl]-(2-methoxyphenyl)methanone
CID 84559095
1H-pyrrolo[3,2-b]pyridin-3-yl-[4-(1,3-thiazol-2-ylmethyl)piperidin-1-yl]methanone
CID 136557542
(2-hydroxyphenyl)-[4-(pyridine-2-carbonyl)piperazin-1-yl]methanone
CID 108534823
1H-indol-3-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 137456369
2-[4-(1H-indol-3-yl)piperidin-1-yl]-N-methylpyridine-3-carboxamide
CID 155948642

Frequently Asked Questions

What is the IUPAC name of (2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone?
The IUPAC name of (2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone (CID 84580016) is (2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone.
What is the SMILES notation for (2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone?
The canonical SMILES for (2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone is O=C(c1ccccc1O)N1CCC(c2c[nH]c3cccnc23)CC1.
What is the InChIKey of (2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone?
The InChIKey is QISNSXATHGOWRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c23-17-6-2-1-4-14(17)19(24)22-10-7-13(8-11-22)15-12-21-16-5-3-9-20-18(15)16/h1-6,9,12-13,21,23H,7-8,10-11H2.
What are the key properties of (2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone?
(2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone has a molecular weight of 321.38 g/mol, XLogP of 3.29, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxyphenyl)-[4-(1H-pyrrolo[3,2-b]pyridin-3-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 84580016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).