2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol

C5H10N4O — CID 66166308

IUPAC2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol
SMILESCn1cnnc1C(O)CN
InChIInChI=1S/C5H10N4O/c1-9-3-7-8-5(9)4(10)2-6/h3-4,10H,2,6H2,1H3
InChIKeyRUJSUFYJEMYSBQ-UHFFFAOYSA-N
MW142.16 g/mol
LogP-1.19
Rot. Bonds2

About 2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol

2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol (PubChem CID 66166308) has the molecular formula C5H10N4O and a molecular weight of 142.16 g/mol. Its IUPAC name is 2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol.

Molecular Properties

Compound Name2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol
PubChem CID66166308
Molecular FormulaC5H10N4O
Molecular Weight142.16 g/mol
Exact Mass142.09
IUPAC Name2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol
SMILESCn1cnnc1C(O)CN
InChIInChI=1S/C5H10N4O/c1-9-3-7-8-5(9)4(10)2-6/h3-4,10H,2,6H2,1H3
InChIKeyRUJSUFYJEMYSBQ-UHFFFAOYSA-N
XLogP-1.19
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-1.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methyl-1,2,4-triazol-3-yl)propan-1-amine;dihydrochloride
CID 75493399
2-methyl-3-(4-methyl-1,2,4-triazol-3-yl)butan-1-amine
CID 131162810
(2R)-2-amino-2-(4-methyl-1,2,4-triazol-3-yl)ethanol
CID 94552496
2-(4-methyl-1,2,4-triazol-3-yl)-2-pyrrolidin-1-ylethanamine
CID 82400069
2,2-dimethyl-1-(4-methyl-1,2,4-triazol-3-yl)butan-1-ol
CID 130758261
2-methyl-1-(4-methyl-1,2,4-triazol-3-yl)propan-1-amine
CID 24693648
2-(aminomethyl)-3-methyl-N-[1-(4-methyl-1,2,4-triazol-3-yl)ethyl]butanamide
CID 55038246
2-[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]ethanol
CID 55211655
1-(4-methyl-1,2,4-triazol-3-yl)ethylthiourea
CID 62116971
4-[(2R)-2-amino-2-(4-methyl-1,2,4-triazol-3-yl)ethyl]phenol
CID 94552493
4-[2-amino-2-(4-methyl-1,2,4-triazol-3-yl)ethyl]phenol
CID 62694256
3-amino-2-methyl-1-(4-methyl-1,2,4-triazol-3-yl)propan-1-one
CID 131182133

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol?
The IUPAC name of 2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol (CID 66166308) is 2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol.
What is the SMILES notation for 2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol?
The canonical SMILES for 2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol is Cn1cnnc1C(O)CN.
What is the InChIKey of 2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol?
The InChIKey is RUJSUFYJEMYSBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4O/c1-9-3-7-8-5(9)4(10)2-6/h3-4,10H,2,6H2,1H3.
What are the key properties of 2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol?
2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol has a molecular weight of 142.16 g/mol, XLogP of -1.19, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(4-methyl-1,2,4-triazol-3-yl)ethanol is sourced from PubChem (CID 66166308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).