N-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide

C14H16N2O3 — CID 110489496

IUPACN-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide
SMILESO=C(NCCOCCO)c1cnc2ccccc2c1
InChIInChI=1S/C14H16N2O3/c17-6-8-19-7-5-15-14(18)12-9-11-3-1-2-4-13(11)16-10-12/h1-4,9-10,17H,5-8H2,(H,15,18)
InChIKeyBIYZVYOJXXNKJB-UHFFFAOYSA-N
MW260.29 g/mol
LogP0.97
Rot. Bonds6

About N-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide

N-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide (PubChem CID 110489496) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is N-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide
PubChem CID110489496
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC NameN-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide
SMILESO=C(NCCOCCO)c1cnc2ccccc2c1
InChIInChI=1S/C14H16N2O3/c17-6-8-19-7-5-15-14(18)12-9-11-3-1-2-4-13(11)16-10-12/h1-4,9-10,17H,5-8H2,(H,15,18)
InChIKeyBIYZVYOJXXNKJB-UHFFFAOYSA-N
XLogP0.97
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)quinoline-3-carboxamide
CID 110694742
N-(5-hydroxypentyl)quinoline-3-carboxamide
CID 110489508
N-[2-(2-hydroxyethoxy)ethyl]quinoline-2-carboxamide
CID 60670699
N-[2-(4-fluorophenyl)ethyl]quinoline-3-carboxamide
CID 110694769
6-(dimethylamino)-N-[2-(2-hydroxyethoxy)ethyl]pyridine-3-carboxamide
CID 55023997
N-[2-(2-hydroxyethoxy)ethyl]-3H-benzimidazole-5-carboxamide;hydrochloride
CID 121379529
2-amino-3-ethyl-N-[2-(2-hydroxyethoxy)ethyl]imidazo[4,5-b]pyridine-6-carboxamide
CID 70739374
N-(2-hydroxyethyl)-6-methoxyquinoline-3-carboxamide
CID 110489941
N-(2-hydroxyethyl)-1,5-naphthyridine-3-carboxamide
CID 91250123
3-fluoro-N-[2-(2-hydroxyethoxy)ethyl]benzamide
CID 60654478
3-hydroxy-2-(quinoline-3-carbonylamino)propanoic acid
CID 110489479
N-[3-(quinoline-3-carbonylamino)phenyl]quinoline-3-carboxamide
CID 171577203

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide?
The IUPAC name of N-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide (CID 110489496) is N-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide.
What is the SMILES notation for N-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide?
The canonical SMILES for N-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide is O=C(NCCOCCO)c1cnc2ccccc2c1.
What is the InChIKey of N-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide?
The InChIKey is BIYZVYOJXXNKJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c17-6-8-19-7-5-15-14(18)12-9-11-3-1-2-4-13(11)16-10-12/h1-4,9-10,17H,5-8H2,(H,15,18).
What are the key properties of N-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide?
N-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide has a molecular weight of 260.29 g/mol, XLogP of 0.97, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-hydroxyethoxy)ethyl]quinoline-3-carboxamide is sourced from PubChem (CID 110489496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).