2-amino-2-(triazol-1-yl)ethanol

C4H8N4O — CID 174538869

IUPAC2-amino-2-(triazol-1-yl)ethanol
SMILESNC(CO)n1ccnn1
InChIInChI=1S/C4H8N4O/c5-4(3-9)8-2-1-6-7-8/h1-2,4,9H,3,5H2
InChIKeyHBUNSGBDWPJWGW-UHFFFAOYSA-N
MW128.13 g/mol
LogP-1.27
Rot. Bonds2

About 2-amino-2-(triazol-1-yl)ethanol

2-amino-2-(triazol-1-yl)ethanol (PubChem CID 174538869) has the molecular formula C4H8N4O and a molecular weight of 128.13 g/mol. Its IUPAC name is 2-amino-2-(triazol-1-yl)ethanol.

Molecular Properties

Compound Name2-amino-2-(triazol-1-yl)ethanol
PubChem CID174538869
Molecular FormulaC4H8N4O
Molecular Weight128.13 g/mol
Exact Mass128.07
IUPAC Name2-amino-2-(triazol-1-yl)ethanol
SMILESNC(CO)n1ccnn1
InChIInChI=1S/C4H8N4O/c5-4(3-9)8-2-1-6-7-8/h1-2,4,9H,3,5H2
InChIKeyHBUNSGBDWPJWGW-UHFFFAOYSA-N
XLogP-1.27
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.13
LogP ≤ 5-1.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2,3-bis(triazol-1-yl)propan-1-ol
CID 118272391
triazol-1-ylmethanol
CID 15568557
2-sulfanyl-2-(triazol-1-yl)acetonitrile
CID 135340388
(1R)-1-[(4R,5R)-5-[fluoro(triazol-1-yl)methyl]-2,2-dimethyl-1,3-dioxolan-4-yl]ethane-1,2-diol;scandium
CID 156864870
N,N-diethyl-1-(triazol-1-yl)propan-1-amine
CID 91155754
3-methoxy-2-(triazol-1-yl)propanamide
CID 91293121
2-(triazol-1-yl)heptanoic acid
CID 69479443
3-amino-5-methyl-2-pyrazol-1-ylhexan-1-ol
CID 114357650
2-[bis(1H-imidazol-2-yl)methyl]-1H-imidazole;1-[bis(triazol-1-yl)methyl]triazole
CID 23295374
N-methyl-N-[2-(triazol-1-yl)propyl]formamide
CID 90155563
1-(4-methyloctan-3-yl)triazole
CID 167298124
1-[(1S)-1-phenylethyl]triazole
CID 175706857

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(triazol-1-yl)ethanol?
The IUPAC name of 2-amino-2-(triazol-1-yl)ethanol (CID 174538869) is 2-amino-2-(triazol-1-yl)ethanol.
What is the SMILES notation for 2-amino-2-(triazol-1-yl)ethanol?
The canonical SMILES for 2-amino-2-(triazol-1-yl)ethanol is NC(CO)n1ccnn1.
What is the InChIKey of 2-amino-2-(triazol-1-yl)ethanol?
The InChIKey is HBUNSGBDWPJWGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N4O/c5-4(3-9)8-2-1-6-7-8/h1-2,4,9H,3,5H2.
What are the key properties of 2-amino-2-(triazol-1-yl)ethanol?
2-amino-2-(triazol-1-yl)ethanol has a molecular weight of 128.13 g/mol, XLogP of -1.27, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(triazol-1-yl)ethanol is sourced from PubChem (CID 174538869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).