2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide

C6H10N4O2 — CID 61216264

IUPAC2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide
SMILESCCOCC(=O)Nc1ncn[nH]1
InChIInChI=1S/C6H10N4O2/c1-2-12-3-5(11)9-6-7-4-8-10-6/h4H,2-3H2,1H3,(H2,7,8,9,10,11)
InChIKeySIOXERUUJYPZKF-UHFFFAOYSA-N
MW170.17 g/mol
LogP-0.22
Rot. Bonds4

About 2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide

2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide (PubChem CID 61216264) has the molecular formula C6H10N4O2 and a molecular weight of 170.17 g/mol. Its IUPAC name is 2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide.

Molecular Properties

Compound Name2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide
PubChem CID61216264
Molecular FormulaC6H10N4O2
Molecular Weight170.17 g/mol
Exact Mass170.08
IUPAC Name2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide
SMILESCCOCC(=O)Nc1ncn[nH]1
InChIInChI=1S/C6H10N4O2/c1-2-12-3-5(11)9-6-7-4-8-10-6/h4H,2-3H2,1H3,(H2,7,8,9,10,11)
InChIKeySIOXERUUJYPZKF-UHFFFAOYSA-N
XLogP-0.22
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.17
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-1,2,4-triazol-5-yl)butanamide
CID 5020131
2-(4-chloro-2-methylphenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide
CID 720861
N-(1H-1,2,4-triazol-5-yl)-2-[4-(trifluoromethyl)phenoxy]acetamide
CID 60506910
2-(3-bromophenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide
CID 698938
5-chloro-N-(1H-1,2,4-triazol-5-yl)pentanamide
CID 63665630
5-oxo-N-(1H-1,2,4-triazol-5-yl)dodecanamide
CID 56696523
2-(2-cyanophenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide
CID 60592154
N-(2-ethoxyphenyl)-N'-(1H-1,2,4-triazol-5-yl)oxamide
CID 108529879
2-ethoxy-N-(1,2,4-thiadiazol-5-yl)acetamide
CID 131160456
2-(4-bromo-2-fluorophenoxy)-N-(1H-1,2,4-triazol-5-yl)acetamide
CID 30866723
2-methoxy-N-(1H-1,2,4-triazol-5-yl)propanamide
CID 115589055
N-ethyl-N-(1H-1,2,4-triazol-5-ylcarbamoyl)carbamate
CID 57349108

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide?
The IUPAC name of 2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide (CID 61216264) is 2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide.
What is the SMILES notation for 2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide?
The canonical SMILES for 2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide is CCOCC(=O)Nc1ncn[nH]1.
What is the InChIKey of 2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide?
The InChIKey is SIOXERUUJYPZKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O2/c1-2-12-3-5(11)9-6-7-4-8-10-6/h4H,2-3H2,1H3,(H2,7,8,9,10,11).
What are the key properties of 2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide?
2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide has a molecular weight of 170.17 g/mol, XLogP of -0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(1H-1,2,4-triazol-5-yl)acetamide is sourced from PubChem (CID 61216264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).