N-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide

C15H18N4O2 — CID 119506992

IUPACN-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide
SMILESCCNCCNC(=O)c1cccc(Oc2cnccn2)c1
InChIInChI=1S/C15H18N4O2/c1-2-16-6-9-19-15(20)12-4-3-5-13(10-12)21-14-11-17-7-8-18-14/h3-5,7-8,10-11,16H,2,6,9H2,1H3,(H,19,20)
InChIKeyJEJUEMNDGVNREK-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.61
Rot. Bonds7

About N-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide

N-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide (PubChem CID 119506992) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is N-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide.

Molecular Properties

Compound NameN-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide
PubChem CID119506992
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC NameN-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide
SMILESCCNCCNC(=O)c1cccc(Oc2cnccn2)c1
InChIInChI=1S/C15H18N4O2/c1-2-16-6-9-19-15(20)12-4-3-5-13(10-12)21-14-11-17-7-8-18-14/h3-5,7-8,10-11,16H,2,6,9H2,1H3,(H,19,20)
InChIKeyJEJUEMNDGVNREK-UHFFFAOYSA-N
XLogP1.61
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-2-methylpropyl)-3-pyrazin-2-yloxybenzamide
CID 119628152
N-[2-(ethylamino)ethyl]-3-(pyridin-3-ylmethoxy)benzamide
CID 119506040
N-(2-aminopentyl)-3-pyrazin-2-yloxybenzamide
CID 86813885
N-(2-aminopentyl)-3-pyrazin-2-yloxybenzamide;dihydrochloride
CID 86813884
N-[2-(ethylamino)ethyl]-3-propoxybenzamide
CID 62919691
N-[2-(ethylamino)ethyl]-3-(2-methoxyethoxy)benzamide
CID 119504539
N-hexyl-3-pyridin-2-yloxybenzamide
CID 90596510
N-octyl-3-pyridin-2-yloxybenzamide
CID 90596511
N-(1-amino-2,3-dimethylbutan-2-yl)-3-pyrazin-2-yloxybenzamide
CID 119607218
4-methoxy-2-[(3-pyrazin-2-yloxybenzoyl)amino]butanoic acid
CID 120703222
3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide
CID 4958095
N-piperidin-4-yl-3-pyrazin-2-yloxybenzamide;dihydrochloride
CID 119388069

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide?
The IUPAC name of N-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide (CID 119506992) is N-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide.
What is the SMILES notation for N-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide?
The canonical SMILES for N-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide is CCNCCNC(=O)c1cccc(Oc2cnccn2)c1.
What is the InChIKey of N-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide?
The InChIKey is JEJUEMNDGVNREK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-2-16-6-9-19-15(20)12-4-3-5-13(10-12)21-14-11-17-7-8-18-14/h3-5,7-8,10-11,16H,2,6,9H2,1H3,(H,19,20).
What are the key properties of N-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide?
N-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide has a molecular weight of 286.34 g/mol, XLogP of 1.61, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylamino)ethyl]-3-pyrazin-2-yloxybenzamide is sourced from PubChem (CID 119506992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).