N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide

C14H18N6O — CID 166602280

About N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide

N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide (PubChem CID 166602280) has the molecular formula C14H18N6O and a molecular weight of 286.34 g/mol. Its IUPAC name is N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide.

Molecular Properties

• Compound Name: N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide
• PubChem CID: 166602280
• Molecular Formula: C14H18N6O
• Molecular Weight: 286.34 g/mol
• Exact Mass: 286.15
• IUPAC Name: N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide
• SMILES: Cc1cc(N2CCC(C(=O)NC3CC3)C2)n2ncnc2n1
• InChI: InChI=1S/C14H18N6O/c1-9-6-12(20-14(17-9)15-8-16-20)19-5-4-10(7-19)13(21)18-11-2-3-11/h6,8,10-11H,2-5,7H2,1H3,(H,18,21)
• InChIKey: FUJXCCJEMXGPBX-UHFFFAOYSA-N
• XLogP: 0.54
• TPSA: 75.42 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 21
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	286.34
LogP ≤ 5	0.54
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide?

The IUPAC name of N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide (CID 166602280) is N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide.

What is the SMILES notation for N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide?

The canonical SMILES for N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide is Cc1cc(N2CCC(C(=O)NC3CC3)C2)n2ncnc2n1.

What is the InChIKey of N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide?

The InChIKey is FUJXCCJEMXGPBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6O/c1-9-6-12(20-14(17-9)15-8-16-20)19-5-4-10(7-19)13(21)18-11-2-3-11/h6,8,10-11H,2-5,7H2,1H3,(H,18,21).

What are the key properties of N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide?

N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide has a molecular weight of 286.34 g/mol, XLogP of 0.54, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-cyclopropyl-1-(5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 166602280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).