N-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide

C10H14N4O2 — CID 103865049

IUPACN-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide
SMILESO=C(NC1CCOC1C1CC1)c1cn[nH]n1
InChIInChI=1S/C10H14N4O2/c15-10(8-5-11-14-13-8)12-7-3-4-16-9(7)6-1-2-6/h5-7,9H,1-4H2,(H,12,15)(H,11,13,14)
InChIKeyCATXGFONFWKWIY-UHFFFAOYSA-N
MW222.25 g/mol
LogP0.10
Rot. Bonds3

About N-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide

N-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide (PubChem CID 103865049) has the molecular formula C10H14N4O2 and a molecular weight of 222.25 g/mol. Its IUPAC name is N-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide
PubChem CID103865049
Molecular FormulaC10H14N4O2
Molecular Weight222.25 g/mol
Exact Mass222.11
IUPAC NameN-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide
SMILESO=C(NC1CCOC1C1CC1)c1cn[nH]n1
InChIInChI=1S/C10H14N4O2/c15-10(8-5-11-14-13-8)12-7-3-4-16-9(7)6-1-2-6/h5-7,9H,1-4H2,(H,12,15)(H,11,13,14)
InChIKeyCATXGFONFWKWIY-UHFFFAOYSA-N
XLogP0.10
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide?
The IUPAC name of N-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide (CID 103865049) is N-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide.
What is the SMILES notation for N-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide?
The canonical SMILES for N-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide is O=C(NC1CCOC1C1CC1)c1cn[nH]n1.
What is the InChIKey of N-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide?
The InChIKey is CATXGFONFWKWIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2/c15-10(8-5-11-14-13-8)12-7-3-4-16-9(7)6-1-2-6/h5-7,9H,1-4H2,(H,12,15)(H,11,13,14).
What are the key properties of N-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide?
N-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide has a molecular weight of 222.25 g/mol, XLogP of 0.10, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropyloxolan-3-yl)-2H-triazole-4-carboxamide is sourced from PubChem (CID 103865049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).