N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide

C8H12N2O2 — CID 102227163

IUPACN-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide
SMILESCC(=O)N[C@@H](C)c1nc(C)co1
InChIInChI=1S/C8H12N2O2/c1-5-4-12-8(9-5)6(2)10-7(3)11/h4,6H,1-3H3,(H,10,11)/t6-/m0/s1
InChIKeyMKKVLPYQKGYHOW-LURJTMIESA-N
MW168.20 g/mol
LogP1.18
Rot. Bonds2

About N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide

N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide (PubChem CID 102227163) has the molecular formula C8H12N2O2 and a molecular weight of 168.20 g/mol. Its IUPAC name is N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide
PubChem CID102227163
Molecular FormulaC8H12N2O2
Molecular Weight168.20 g/mol
Exact Mass168.09
IUPAC NameN-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide
SMILESCC(=O)N[C@@H](C)c1nc(C)co1
InChIInChI=1S/C8H12N2O2/c1-5-4-12-8(9-5)6(2)10-7(3)11/h4,6H,1-3H3,(H,10,11)/t6-/m0/s1
InChIKeyMKKVLPYQKGYHOW-LURJTMIESA-N
XLogP1.18
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[(1S)-1-acetamidoethyl]-1,3-oxazole-4-carboxylate
CID 70848419
2-hydroxy-2-(4-methyl-1,3-oxazol-2-yl)acetic acid
CID 82415982
2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol
CID 13159076
ethane;N-[1-(6-methyl-2-pyridinyl)ethyl]acetamide
CID 177366227
(2S)-2-[(4-methyl-1,3-oxazole-2-carbonyl)amino]propanoic acid
CID 83617838
3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol
CID 82416174
N-[1-(6-methylpyridazin-3-yl)ethyl]acetamide
CID 170758680
N-[(1S)-1-(6-methyl-3-pyridinyl)ethyl]acetamide
CID 100987523
4-methyl-1,3-oxazole-2-carboxamide
CID 15116130
N-[1-(furan-2-yl)ethyl]acetamide
CID 22460009
4-methyl-2-pentan-2-yl-1,3-oxazole
CID 145099076
tert-butyl N-[1-[4-(hydroxymethyl)-1,3-oxazol-2-yl]ethyl]carbamate
CID 68670260

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide?
The IUPAC name of N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide (CID 102227163) is N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide.
What is the SMILES notation for N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide?
The canonical SMILES for N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide is CC(=O)N[C@@H](C)c1nc(C)co1.
What is the InChIKey of N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide?
The InChIKey is MKKVLPYQKGYHOW-LURJTMIESA-N. The full InChI is InChI=1S/C8H12N2O2/c1-5-4-12-8(9-5)6(2)10-7(3)11/h4,6H,1-3H3,(H,10,11)/t6-/m0/s1.
What are the key properties of N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide?
N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide has a molecular weight of 168.20 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide is sourced from PubChem (CID 102227163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).