N-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide

C11H13N5O2 — CID 91891380

IUPACN-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide
SMILESCc1cn2nnc(C(=O)NCC3CC3)c2c(=O)[nH]1
InChIInChI=1S/C11H13N5O2/c1-6-5-16-9(11(18)13-6)8(14-15-16)10(17)12-4-7-2-3-7/h5,7H,2-4H2,1H3,(H,12,17)(H,13,18)
InChIKeyZDIZZBXLSHVPOQ-UHFFFAOYSA-N
MW247.26 g/mol
LogP-0.13
Rot. Bonds3

About N-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide

N-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide (PubChem CID 91891380) has the molecular formula C11H13N5O2 and a molecular weight of 247.26 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide
PubChem CID91891380
Molecular FormulaC11H13N5O2
Molecular Weight247.26 g/mol
Exact Mass247.11
IUPAC NameN-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide
SMILESCc1cn2nnc(C(=O)NCC3CC3)c2c(=O)[nH]1
InChIInChI=1S/C11H13N5O2/c1-6-5-16-9(11(18)13-6)8(14-15-16)10(17)12-4-7-2-3-7/h5,7H,2-4H2,1H3,(H,12,17)(H,13,18)
InChIKeyZDIZZBXLSHVPOQ-UHFFFAOYSA-N
XLogP-0.13
TPSA92.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.26
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide (CID 91891380) is N-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide is Cc1cn2nnc(C(=O)NCC3CC3)c2c(=O)[nH]1.
What is the InChIKey of N-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide?
The InChIKey is ZDIZZBXLSHVPOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O2/c1-6-5-16-9(11(18)13-6)8(14-15-16)10(17)12-4-7-2-3-7/h5,7H,2-4H2,1H3,(H,12,17)(H,13,18).
What are the key properties of N-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide?
N-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide has a molecular weight of 247.26 g/mol, XLogP of -0.13, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-6-methyl-4-oxo-5H-triazolo[1,5-a]pyrazine-3-carboxamide is sourced from PubChem (CID 91891380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).