N-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide

C15H20N4O2 — CID 109468449

IUPACN-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide
SMILESCCN(CCO)C(=O)c1ccc(-c2nncn2CC)cc1
InChIInChI=1S/C15H20N4O2/c1-3-18(9-10-20)15(21)13-7-5-12(6-8-13)14-17-16-11-19(14)4-2/h5-8,11,20H,3-4,9-10H2,1-2H3
InChIKeyQGYASOWJYFVHDM-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.42
Rot. Bonds6

About N-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide

N-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide (PubChem CID 109468449) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound NameN-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide
PubChem CID109468449
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC NameN-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide
SMILESCCN(CCO)C(=O)c1ccc(-c2nncn2CC)cc1
InChIInChI=1S/C15H20N4O2/c1-3-18(9-10-20)15(21)13-7-5-12(6-8-13)14-17-16-11-19(14)4-2/h5-8,11,20H,3-4,9-10H2,1-2H3
InChIKeyQGYASOWJYFVHDM-UHFFFAOYSA-N
XLogP1.42
TPSA71.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-N-(2-hydroxyethyl)-4-(1,3-thiazol-4-yl)benzamide
CID 109468370
4-(chloromethyl)-N-ethyl-N-(2-hydroxyethyl)benzamide
CID 60948392
N-ethyl-N-(2-hydroxyethyl)-4-methoxybenzamide
CID 39245676
N,N-diethyl-4-(1,3,4-oxadiazol-2-yl)benzamide
CID 60656525
N-ethyl-N-(2-hydroxyethyl)pyridazine-4-carboxamide
CID 115769350
N-ethyl-N-(2-hydroxyethyl)-4-methylsulfinylbenzamide
CID 78855550
ethane;N-(2-hydroxyethyl)-4-methyl-N-propylbenzamide
CID 176553147
N-ethyl-N-(2-hydroxyethyl)-4-(1H-pyrrole-3-carbonyl)benzamide
CID 97237392
N-ethyl-N-(2-hydroxyethyl)-3-(2-methylphenyl)-5-(tetrazol-1-yl)benzamide
CID 56859401
4-(4-ethyl-1,2,4-triazol-3-yl)-2-methylaniline
CID 62693006
2-(azepan-1-yl)-N-ethyl-N-(2-hydroxyethyl)pyridine-4-carboxamide
CID 84574449
6-ethoxy-N-ethyl-N-(2-hydroxyethyl)pyridine-3-carboxamide
CID 78887407

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide?
The IUPAC name of N-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide (CID 109468449) is N-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide.
What is the SMILES notation for N-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide?
The canonical SMILES for N-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide is CCN(CCO)C(=O)c1ccc(-c2nncn2CC)cc1.
What is the InChIKey of N-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide?
The InChIKey is QGYASOWJYFVHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-3-18(9-10-20)15(21)13-7-5-12(6-8-13)14-17-16-11-19(14)4-2/h5-8,11,20H,3-4,9-10H2,1-2H3.
What are the key properties of N-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide?
N-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide has a molecular weight of 288.35 g/mol, XLogP of 1.42, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(4-ethyl-1,2,4-triazol-3-yl)-N-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 109468449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).