2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide

C14H21N5O2S — CID 118762665

IUPAC2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide
SMILESCCNc1nc(C)c(C(=O)NC(C)c2nnc(C(C)C)o2)s1
InChIInChI=1S/C14H21N5O2S/c1-6-15-14-17-8(4)10(22-14)11(20)16-9(5)13-19-18-12(21-13)7(2)3/h7,9H,6H2,1-5H3,(H,15,17)(H,16,20)
InChIKeyUUDYEHFOQBRHSJ-UHFFFAOYSA-N
MW323.42 g/mol
LogP2.88
Rot. Bonds6

About 2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide

2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide (PubChem CID 118762665) has the molecular formula C14H21N5O2S and a molecular weight of 323.42 g/mol. Its IUPAC name is 2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide
PubChem CID118762665
Molecular FormulaC14H21N5O2S
Molecular Weight323.42 g/mol
Exact Mass323.14
IUPAC Name2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide
SMILESCCNc1nc(C)c(C(=O)NC(C)c2nnc(C(C)C)o2)s1
InChIInChI=1S/C14H21N5O2S/c1-6-15-14-17-8(4)10(22-14)11(20)16-9(5)13-19-18-12(21-13)7(2)3/h7,9H,6H2,1-5H3,(H,15,17)(H,16,20)
InChIKeyUUDYEHFOQBRHSJ-UHFFFAOYSA-N
XLogP2.88
TPSA92.94 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.42
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide (CID 118762665) is 2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide is CCNc1nc(C)c(C(=O)NC(C)c2nnc(C(C)C)o2)s1.
What is the InChIKey of 2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide?
The InChIKey is UUDYEHFOQBRHSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2S/c1-6-15-14-17-8(4)10(22-14)11(20)16-9(5)13-19-18-12(21-13)7(2)3/h7,9H,6H2,1-5H3,(H,15,17)(H,16,20).
What are the key properties of 2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide?
2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide has a molecular weight of 323.42 g/mol, XLogP of 2.88, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-4-methyl-N-[1-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)ethyl]-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 118762665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).