N-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide

C12H14N6O2 — CID 138723430

IUPACN-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
SMILESO=C(NCC(=O)N1CCCC1)c1ccnc2ncnn12
InChIInChI=1S/C12H14N6O2/c19-10(17-5-1-2-6-17)7-14-11(20)9-3-4-13-12-15-8-16-18(9)12/h3-4,8H,1-2,5-7H2,(H,14,20)
InChIKeyATCURXUQQHIVSG-UHFFFAOYSA-N
MW274.28 g/mol
LogP-0.52
Rot. Bonds3

About N-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide

N-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide (PubChem CID 138723430) has the molecular formula C12H14N6O2 and a molecular weight of 274.28 g/mol. Its IUPAC name is N-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide.

Molecular Properties

Compound NameN-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
PubChem CID138723430
Molecular FormulaC12H14N6O2
Molecular Weight274.28 g/mol
Exact Mass274.12
IUPAC NameN-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide
SMILESO=C(NCC(=O)N1CCCC1)c1ccnc2ncnn12
InChIInChI=1S/C12H14N6O2/c19-10(17-5-1-2-6-17)7-14-11(20)9-3-4-13-12-15-8-16-18(9)12/h3-4,8H,1-2,5-7H2,(H,14,20)
InChIKeyATCURXUQQHIVSG-UHFFFAOYSA-N
XLogP-0.52
TPSA92.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.28
LogP ≤ 5-0.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide with MolForge

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Related Compounds

2-methyl-N-(2-oxo-2-piperidin-1-ylethyl)pyrazole-3-carboxamide
CID 95043723
N-[2-oxo-2-[4-[2-(pyridine-4-carbonylamino)acetyl]-1,4-diazepan-1-yl]ethyl]pyridine-4-carboxamide
CID 166219117
5-[(2-oxo-2-piperidin-1-ylethyl)carbamoyl]pyrazine-2-carboxylic acid
CID 120685506
6-chloro-N-(2-oxo-2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
CID 46525121
3-chloro-N-(2-oxo-2-piperidin-1-ylethyl)pyridine-4-carboxamide
CID 112695851
2-[(2-chloropyrimidin-4-yl)amino]-1-pyrrolidin-1-ylethanone
CID 115695339
5-chloro-N-(2-oxo-2-pyrrolidin-1-ylethyl)pyrazine-2-carboxamide
CID 103803397
3-[(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]-1-piperidin-1-ylpropan-1-one
CID 56815508
N-[2-(4-ethylpiperazin-1-yl)-2-oxoethyl]-2-(2,2,2-trifluoroethyl)pyrazole-3-carboxamide
CID 167911710
N-(2-oxo-2-pyrrolidin-1-ylethyl)-7-propan-2-ylquinoline-4-carboxamide
CID 169159704
N-[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl]-2-methylpyrazole-3-carboxamide
CID 97465236
N-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-2-methylpyrazole-3-carboxamide
CID 91945694

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide?
The IUPAC name of N-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide (CID 138723430) is N-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide.
What is the SMILES notation for N-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide?
The canonical SMILES for N-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide is O=C(NCC(=O)N1CCCC1)c1ccnc2ncnn12.
What is the InChIKey of N-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide?
The InChIKey is ATCURXUQQHIVSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6O2/c19-10(17-5-1-2-6-17)7-14-11(20)9-3-4-13-12-15-8-16-18(9)12/h3-4,8H,1-2,5-7H2,(H,14,20).
What are the key properties of N-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide?
N-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide has a molecular weight of 274.28 g/mol, XLogP of -0.52, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-7-carboxamide is sourced from PubChem (CID 138723430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).