N-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide

C7H10N2O3 — CID 141207168

IUPACN-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide
SMILESO=C(NOCCO)c1ccc[nH]1
InChIInChI=1S/C7H10N2O3/c10-4-5-12-9-7(11)6-2-1-3-8-6/h1-3,8,10H,4-5H2,(H,9,11)
InChIKeyMAABEQIGSINRDB-UHFFFAOYSA-N
MW170.17 g/mol
LogP-0.33
Rot. Bonds4

About N-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide

N-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide (PubChem CID 141207168) has the molecular formula C7H10N2O3 and a molecular weight of 170.17 g/mol. Its IUPAC name is N-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide
PubChem CID141207168
Molecular FormulaC7H10N2O3
Molecular Weight170.17 g/mol
Exact Mass170.07
IUPAC NameN-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide
SMILESO=C(NOCCO)c1ccc[nH]1
InChIInChI=1S/C7H10N2O3/c10-4-5-12-9-7(11)6-2-1-3-8-6/h1-3,8,10H,4-5H2,(H,9,11)
InChIKeyMAABEQIGSINRDB-UHFFFAOYSA-N
XLogP-0.33
TPSA74.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.17
LogP ≤ 5-0.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide?
The IUPAC name of N-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide (CID 141207168) is N-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide.
What is the SMILES notation for N-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide?
The canonical SMILES for N-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide is O=C(NOCCO)c1ccc[nH]1.
What is the InChIKey of N-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide?
The InChIKey is MAABEQIGSINRDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O3/c10-4-5-12-9-7(11)6-2-1-3-8-6/h1-3,8,10H,4-5H2,(H,9,11).
What are the key properties of N-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide?
N-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide has a molecular weight of 170.17 g/mol, XLogP of -0.33, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethoxy)-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 141207168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).