2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine

C17H21N5O — CID 121351275

IUPAC2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine
SMILESCC(C)c1cccc(CN2C=C(N)N=C(c3ncco3)C2C)n1
InChIInChI=1S/C17H21N5O/c1-11(2)14-6-4-5-13(20-14)9-22-10-15(18)21-16(12(22)3)17-19-7-8-23-17/h4-8,10-12H,9,18H2,1-3H3
InChIKeyFAAFISZKEONBHR-UHFFFAOYSA-N
MW311.39 g/mol
LogP2.64
Rot. Bonds4

About 2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine

2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine (PubChem CID 121351275) has the molecular formula C17H21N5O and a molecular weight of 311.39 g/mol. Its IUPAC name is 2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine.

Molecular Properties

Compound Name2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine
PubChem CID121351275
Molecular FormulaC17H21N5O
Molecular Weight311.39 g/mol
Exact Mass311.17
IUPAC Name2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine
SMILESCC(C)c1cccc(CN2C=C(N)N=C(c3ncco3)C2C)n1
InChIInChI=1S/C17H21N5O/c1-11(2)14-6-4-5-13(20-14)9-22-10-15(18)21-16(12(22)3)17-19-7-8-23-17/h4-8,10-12H,9,18H2,1-3H3
InChIKeyFAAFISZKEONBHR-UHFFFAOYSA-N
XLogP2.64
TPSA80.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine?
The IUPAC name of 2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine (CID 121351275) is 2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine.
What is the SMILES notation for 2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine?
The canonical SMILES for 2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine is CC(C)c1cccc(CN2C=C(N)N=C(c3ncco3)C2C)n1.
What is the InChIKey of 2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine?
The InChIKey is FAAFISZKEONBHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N5O/c1-11(2)14-6-4-5-13(20-14)9-22-10-15(18)21-16(12(22)3)17-19-7-8-23-17/h4-8,10-12H,9,18H2,1-3H3.
What are the key properties of 2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine?
2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine has a molecular weight of 311.39 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(1,3-oxazol-2-yl)-1-[(6-propan-2-yl-2-pyridinyl)methyl]-2H-pyrazin-5-amine is sourced from PubChem (CID 121351275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).