5-cyclopropyl-2H-triazol-4-amine

C5H8N4 — CID 79537683

IUPAC5-cyclopropyl-2H-triazol-4-amine
SMILESNc1n[nH]nc1C1CC1
InChIInChI=1S/C5H8N4/c6-5-4(3-1-2-3)7-9-8-5/h3H,1-2H2,(H3,6,7,8,9)
InChIKeyDMJHGYHERMHAJW-UHFFFAOYSA-N
MW124.15 g/mol
LogP0.26
Rot. Bonds1

About 5-cyclopropyl-2H-triazol-4-amine

5-cyclopropyl-2H-triazol-4-amine (PubChem CID 79537683) has the molecular formula C5H8N4 and a molecular weight of 124.15 g/mol. Its IUPAC name is 5-cyclopropyl-2H-triazol-4-amine.

Molecular Properties

Compound Name5-cyclopropyl-2H-triazol-4-amine
PubChem CID79537683
Molecular FormulaC5H8N4
Molecular Weight124.15 g/mol
Exact Mass124.07
IUPAC Name5-cyclopropyl-2H-triazol-4-amine
SMILESNc1n[nH]nc1C1CC1
InChIInChI=1S/C5H8N4/c6-5-4(3-1-2-3)7-9-8-5/h3H,1-2H2,(H3,6,7,8,9)
InChIKeyDMJHGYHERMHAJW-UHFFFAOYSA-N
XLogP0.26
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.15
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-cyclopentyl-2H-triazol-4-amine
CID 105429790
5-cycloheptyl-2H-triazol-4-amine
CID 105439081
4-bromo-5-cyclopropyl-2H-triazole
CID 71303694
5-cyclopropyl-2H-triazole-4-carbonitrile
CID 82377924
3-cyclopropylpyrazin-2-amine
CID 55285123
5-cyclobutyl-2H-triazole-4-carbaldehyde
CID 105429558
2-(5-cyclopropyl-2H-triazol-4-yl)-2-methylpropanoic acid
CID 82400386
5-cyclobutyl-2H-triazole-4-carboxylic acid
CID 105433344
4-cyclopropyl-2-(2-methylpropyl)pyrimidin-5-amine
CID 130483729
5-cyclopropyl-N,N-bis(prop-2-enyl)-2H-triazole-4-carboxamide
CID 166309180
5-piperidin-4-yl-2H-triazole-4-carboxylic acid
CID 103123476
5-cyclopropyl-4-propyl-1H-pyrazol-3-amine
CID 79406037

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-2H-triazol-4-amine?
The IUPAC name of 5-cyclopropyl-2H-triazol-4-amine (CID 79537683) is 5-cyclopropyl-2H-triazol-4-amine.
What is the SMILES notation for 5-cyclopropyl-2H-triazol-4-amine?
The canonical SMILES for 5-cyclopropyl-2H-triazol-4-amine is Nc1n[nH]nc1C1CC1.
What is the InChIKey of 5-cyclopropyl-2H-triazol-4-amine?
The InChIKey is DMJHGYHERMHAJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4/c6-5-4(3-1-2-3)7-9-8-5/h3H,1-2H2,(H3,6,7,8,9).
What are the key properties of 5-cyclopropyl-2H-triazol-4-amine?
5-cyclopropyl-2H-triazol-4-amine has a molecular weight of 124.15 g/mol, XLogP of 0.26, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-2H-triazol-4-amine is sourced from PubChem (CID 79537683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).