N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide

C14H20N6O — CID 126436988

IUPACN-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide
SMILESCC(C)n1cnnc1[C@@H](C)NC(=O)CCc1cnccn1
InChIInChI=1S/C14H20N6O/c1-10(2)20-9-17-19-14(20)11(3)18-13(21)5-4-12-8-15-6-7-16-12/h6-11H,4-5H2,1-3H3,(H,18,21)/t11-/m1/s1
InChIKeyMXUAQPQMOGDXSM-LLVKDONJSA-N
MW288.35 g/mol
LogP1.46
Rot. Bonds6

About N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide

N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide (PubChem CID 126436988) has the molecular formula C14H20N6O and a molecular weight of 288.35 g/mol. Its IUPAC name is N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide.

Molecular Properties

Compound NameN-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide
PubChem CID126436988
Molecular FormulaC14H20N6O
Molecular Weight288.35 g/mol
Exact Mass288.17
IUPAC NameN-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide
SMILESCC(C)n1cnnc1[C@@H](C)NC(=O)CCc1cnccn1
InChIInChI=1S/C14H20N6O/c1-10(2)20-9-17-19-14(20)11(3)18-13(21)5-4-12-8-15-6-7-16-12/h6-11H,4-5H2,1-3H3,(H,18,21)/t11-/m1/s1
InChIKeyMXUAQPQMOGDXSM-LLVKDONJSA-N
XLogP1.46
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide with MolForge

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Related Compounds

[4-[1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethylamino]piperidin-1-yl]-pyrazin-2-ylmethanone
CID 131905619
2-(2-oxo-1-pyridinyl)-N-[(1S)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]acetamide
CID 126450812
N-(2-methylbutyl)-3-pyrazin-2-ylpropanamide;molecular hydrogen
CID 170981994
N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-4-pyridin-4-ylpiperazine-1-carboxamide
CID 126429294
6-cyano-N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]pyridine-3-carboxamide
CID 125164685
N-[1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-4-pyrimidin-5-ylbenzamide
CID 119066722
N-[(1R)-1-(4-methyl-1,2,4-triazol-3-yl)ethyl]-4-pyrazin-2-ylpiperazine-1-carboxamide
CID 94119889
5-[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]-5-oxopentanoic acid
CID 54867804
6-[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]-6-oxohexanoic acid
CID 54867805
1-pyrazin-2-ylhexan-3-one
CID 64504751
N-[(3R,4S)-1-methylsulfonyl-4-propan-2-ylpyrrolidin-3-yl]-3-pyrazin-2-ylpropanamide
CID 72882396
N-[(1S)-1-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]-3-pyridin-2-ylpropanamide
CID 97306373

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide?
The IUPAC name of N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide (CID 126436988) is N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide.
What is the SMILES notation for N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide?
The canonical SMILES for N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide is CC(C)n1cnnc1[C@@H](C)NC(=O)CCc1cnccn1.
What is the InChIKey of N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide?
The InChIKey is MXUAQPQMOGDXSM-LLVKDONJSA-N. The full InChI is InChI=1S/C14H20N6O/c1-10(2)20-9-17-19-14(20)11(3)18-13(21)5-4-12-8-15-6-7-16-12/h6-11H,4-5H2,1-3H3,(H,18,21)/t11-/m1/s1.
What are the key properties of N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide?
N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide has a molecular weight of 288.35 g/mol, XLogP of 1.46, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(4-propan-2-yl-1,2,4-triazol-3-yl)ethyl]-3-pyrazin-2-ylpropanamide is sourced from PubChem (CID 126436988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).