1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide

C5H8N4O2 — CID 45084435

IUPAC1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide
SMILESNC(=O)c1ncn(CCO)n1
InChIInChI=1S/C5H8N4O2/c6-4(11)5-7-3-9(8-5)1-2-10/h3,10H,1-2H2,(H2,6,11)
InChIKeyYBYISVWIQKDVIV-UHFFFAOYSA-N
MW156.15 g/mol
LogP-1.63
Rot. Bonds3

About 1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide

1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide (PubChem CID 45084435) has the molecular formula C5H8N4O2 and a molecular weight of 156.15 g/mol. Its IUPAC name is 1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide.

Molecular Properties

Compound Name1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide
PubChem CID45084435
Molecular FormulaC5H8N4O2
Molecular Weight156.15 g/mol
Exact Mass156.06
IUPAC Name1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide
SMILESNC(=O)c1ncn(CCO)n1
InChIInChI=1S/C5H8N4O2/c6-4(11)5-7-3-9(8-5)1-2-10/h3,10H,1-2H2,(H2,6,11)
InChIKeyYBYISVWIQKDVIV-UHFFFAOYSA-N
XLogP-1.63
TPSA94.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.15
LogP ≤ 5-1.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-Hydroxyethoxymethyl)-1,2,4-triazole-3-carboxamide
CID 14038870
1-(1,5-Dihydroxy-3-oxapent-2-yl)-1,2,4-triazole-5-carboxamide
CID 189928
2-(3-carbamoyl-1H-1,2,4-triazol-1-yl)acetic acid
CID 122155261
1-(2-Hydroxyethoxymethyl)-1,2,4-tiazole-5-carboxamide
CID 125963
2-[2-(Trifluoromethoxy)ethyl]-1,2,4-triazole-3-carboxamide
CID 175864500
2-[2-(Difluoromethoxy)ethyl]-1,2,4-triazole-3-carboxamide
CID 175864558
5-Amino-2-(2-hydroxyethoxymethyl)-1,2,4-triazole-3-carboxamide
CID 101491223
N-(2-hydroxyethyl)-1H-1,2,4-triazole-5-carboxamide
CID 3614694
1-ethyl-1H-1,2,4-triazole-5-carboxamide
CID 13568525
1-Propan-2-yl-1,2,4-triazole-3-carboxamide
CID 20680311
1-(1-Ethoxyethyl)-1,2,4-triazole-3-carboxamide
CID 21498942
2-(1-Ethoxyethyl)-1,2,4-triazole-3-carboxamide
CID 21498943

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide?
The IUPAC name of 1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide (CID 45084435) is 1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide.
What is the SMILES notation for 1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide?
The canonical SMILES for 1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide is NC(=O)c1ncn(CCO)n1.
What is the InChIKey of 1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide?
The InChIKey is YBYISVWIQKDVIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4O2/c6-4(11)5-7-3-9(8-5)1-2-10/h3,10H,1-2H2,(H2,6,11).
What are the key properties of 1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide?
1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide has a molecular weight of 156.15 g/mol, XLogP of -1.63, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxyethyl)-1,2,4-triazole-3-carboxamide is sourced from PubChem (CID 45084435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).