N-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide

C10H11N3O2 — CID 141297998

IUPACN-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide
SMILESO=C(NCCO)C1=CN=C2N=CC=C2C1
InChIInChI=1S/C10H11N3O2/c14-4-3-12-10(15)8-5-7-1-2-11-9(7)13-6-8/h1-2,6,14H,3-5H2,(H,12,15)
InChIKeyBDZVGKHRMVDSCC-UHFFFAOYSA-N
MW205.22 g/mol
LogP-0.21
Rot. Bonds3

About N-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide

N-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide (PubChem CID 141297998) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide
PubChem CID141297998
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC NameN-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide
SMILESO=C(NCCO)C1=CN=C2N=CC=C2C1
InChIInChI=1S/C10H11N3O2/c14-4-3-12-10(15)8-5-7-1-2-11-9(7)13-6-8/h1-2,6,14H,3-5H2,(H,12,15)
InChIKeyBDZVGKHRMVDSCC-UHFFFAOYSA-N
XLogP-0.21
TPSA74.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-4H-pyrrolo[2,3-b]pyridine-5-carboxamide
CID 67203949
N-(2-methoxyethyl)-N-methyl-4H-pyrrolo[2,3-b]pyridine-5-carboxamide
CID 141167511
N-[4-(dimethylamino)butyl]-4H-pyrrolo[2,3-b]pyridine-5-carboxamide
CID 161375684

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide (CID 141297998) is N-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide is O=C(NCCO)C1=CN=C2N=CC=C2C1.
What is the InChIKey of N-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide?
The InChIKey is BDZVGKHRMVDSCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c14-4-3-12-10(15)8-5-7-1-2-11-9(7)13-6-8/h1-2,6,14H,3-5H2,(H,12,15).
What are the key properties of N-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide?
N-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide has a molecular weight of 205.22 g/mol, XLogP of -0.21, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-4H-pyrrolo[2,3-b]pyridine-5-carboxamide is sourced from PubChem (CID 141297998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).