2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol

C8H13NO2 — CID 13159076

IUPAC2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol
SMILESCc1coc(C(O)C(C)C)n1
InChIInChI=1S/C8H13NO2/c1-5(2)7(10)8-9-6(3)4-11-8/h4-5,7,10H,1-3H3
InChIKeyJDHKVSYIZANENX-UHFFFAOYSA-N
MW155.20 g/mol
LogP1.67
Rot. Bonds2

About 2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol

2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol (PubChem CID 13159076) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is 2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol.

Molecular Properties

Compound Name2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol
PubChem CID13159076
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC Name2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol
SMILESCc1coc(C(O)C(C)C)n1
InChIInChI=1S/C8H13NO2/c1-5(2)7(10)8-9-6(3)4-11-8/h4-5,7,10H,1-3H3
InChIKeyJDHKVSYIZANENX-UHFFFAOYSA-N
XLogP1.67
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-hydroxy-2-(4-methyl-1,3-oxazol-2-yl)acetic acid
CID 82415982
3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol
CID 82416174
(4-methyl-1,3-oxazol-2-yl)-phenylmethanol
CID 13159069
N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide
CID 102227163
4-methyl-2-pentan-2-yl-1,3-oxazole
CID 145099076
1-(4-methyl-1,3-oxazol-2-yl)butan-1-amine
CID 82416558
(2S)-1-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]propan-2-ol
CID 106933459
4-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]butan-2-ol
CID 106923608
4-methyl-1,3-oxazole-2-carboxamide
CID 15116130
1-(2,6-dimethyl-3-pyridinyl)-2-methylpropan-1-ol
CID 105133610
(1S)-1-[2-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]phenyl]ethanol
CID 106926965
2-chloro-4-methyl-1,3-oxazole;hydrochloride
CID 139022515

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol?
The IUPAC name of 2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol (CID 13159076) is 2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol.
What is the SMILES notation for 2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol?
The canonical SMILES for 2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol is Cc1coc(C(O)C(C)C)n1.
What is the InChIKey of 2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol?
The InChIKey is JDHKVSYIZANENX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-5(2)7(10)8-9-6(3)4-11-8/h4-5,7,10H,1-3H3.
What are the key properties of 2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol?
2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol has a molecular weight of 155.20 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol is sourced from PubChem (CID 13159076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).