(5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol

C8H15NO2 — CID 22121110

IUPAC(5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol
SMILESCCCC1=NOC(C)(CO)C1
InChIInChI=1S/C8H15NO2/c1-3-4-7-5-8(2,6-10)11-9-7/h10H,3-6H2,1-2H3
InChIKeyDZZNTJJNLBMRQW-UHFFFAOYSA-N
MW157.21 g/mol
LogP1.31
Rot. Bonds3

About (5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol

(5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol (PubChem CID 22121110) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is (5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol.

Molecular Properties

Compound Name(5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol
PubChem CID22121110
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name(5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol
SMILESCCCC1=NOC(C)(CO)C1
InChIInChI=1S/C8H15NO2/c1-3-4-7-5-8(2,6-10)11-9-7/h10H,3-6H2,1-2H3
InChIKeyDZZNTJJNLBMRQW-UHFFFAOYSA-N
XLogP1.31
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-Tert-butyl-5-hydroxymethyl-5-methylisoxazoline
CID 10997486
2-(3-Butyl-4,5-dihydro-1,2-oxazol-5-yl)-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 143474136
(3-Butyl-4,5-dihydro-1,2-oxazol-5-yl)methanol
CID 64167041
[(5R)-3-ethyl-5-methyl-4H-1,2-oxazol-5-yl]methanol
CID 122400074
[(5S)-3-ethyl-5-propan-2-yl-4H-1,2-oxazol-5-yl]methanol
CID 134966928
3-(1,1-Dimethylethyl)-5,6-dihydro-6-methyl-4H-1,2-oxazine-6-methanol
CID 15335307
(3-Propyl-4,5-dihydro-1,2-oxazol-5-yl)methanol
CID 22121098
(3,5-dimethyl-4H-1,2-oxazol-5-yl)methanol
CID 22121131
(3,5-ditert-butyl-4H-1,2-oxazol-5-yl)methanol
CID 58735358
[3-(2-Methylpropyl)-4,5-dihydro-1,2-oxazol-5-yl]methanol
CID 58871535
[5-(hydroxymethyl)-3-methyl-4H-1,2-oxazol-5-yl]methanol
CID 89224822
(3R,4S)-5-methoxyimino-2,4-dimethylheptane-2,3-diol
CID 89970056

Frequently Asked Questions

What is the IUPAC name of (5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol?
The IUPAC name of (5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol (CID 22121110) is (5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol.
What is the SMILES notation for (5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol?
The canonical SMILES for (5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol is CCCC1=NOC(C)(CO)C1.
What is the InChIKey of (5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol?
The InChIKey is DZZNTJJNLBMRQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-3-4-7-5-8(2,6-10)11-9-7/h10H,3-6H2,1-2H3.
What are the key properties of (5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol?
(5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol has a molecular weight of 157.21 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyl-3-propyl-4H-1,2-oxazol-5-yl)methanol is sourced from PubChem (CID 22121110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).