N-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

C15H23N5O2 — CID 32953696

IUPACN-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCOCCN(CC(C)C)C(=O)c1nc2nc(C)cc(C)n2n1
InChIInChI=1S/C15H23N5O2/c1-10(2)9-19(6-7-22-5)14(21)13-17-15-16-11(3)8-12(4)20(15)18-13/h8,10H,6-7,9H2,1-5H3
InChIKeyOVMUHDHYMWZDPV-UHFFFAOYSA-N
MW305.38 g/mol
LogP1.49
Rot. Bonds6

About N-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

N-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 32953696) has the molecular formula C15H23N5O2 and a molecular weight of 305.38 g/mol. Its IUPAC name is N-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID32953696
Molecular FormulaC15H23N5O2
Molecular Weight305.38 g/mol
Exact Mass305.19
IUPAC NameN-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCOCCN(CC(C)C)C(=O)c1nc2nc(C)cc(C)n2n1
InChIInChI=1S/C15H23N5O2/c1-10(2)9-19(6-7-22-5)14(21)13-17-15-16-11(3)8-12(4)20(15)18-13/h8,10H,6-7,9H2,1-5H3
InChIKeyOVMUHDHYMWZDPV-UHFFFAOYSA-N
XLogP1.49
TPSA72.62 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide (CID 32953696) is N-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide is COCCN(CC(C)C)C(=O)c1nc2nc(C)cc(C)n2n1.
What is the InChIKey of N-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is OVMUHDHYMWZDPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O2/c1-10(2)9-19(6-7-22-5)14(21)13-17-15-16-11(3)8-12(4)20(15)18-13/h8,10H,6-7,9H2,1-5H3.
What are the key properties of N-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
N-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 1.49, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-5,7-dimethyl-N-(2-methylpropyl)-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 32953696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).