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

C7H12N2O2 — CID 82416174

IUPAC3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol
SMILESCc1coc(C(O)CCN)n1
InChIInChI=1S/C7H12N2O2/c1-5-4-11-7(9-5)6(10)2-3-8/h4,6,10H,2-3,8H2,1H3
InChIKeyPXGVBQRNVKTGGO-UHFFFAOYSA-N
MW156.19 g/mol
LogP0.37
Rot. Bonds3

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

3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol (PubChem CID 82416174) has the molecular formula C7H12N2O2 and a molecular weight of 156.19 g/mol. Its IUPAC name is 3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol.

Molecular Properties

Compound Name3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol
PubChem CID82416174
Molecular FormulaC7H12N2O2
Molecular Weight156.19 g/mol
Exact Mass156.09
IUPAC Name3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol
SMILESCc1coc(C(O)CCN)n1
InChIInChI=1S/C7H12N2O2/c1-5-4-11-7(9-5)6(10)2-3-8/h4,6,10H,2-3,8H2,1H3
InChIKeyPXGVBQRNVKTGGO-UHFFFAOYSA-N
XLogP0.37
TPSA72.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 50.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol
CID 13159076
1-(4-methyl-1,3-oxazol-2-yl)butan-1-amine
CID 82416558
2-hydroxy-2-(4-methyl-1,3-oxazol-2-yl)acetic acid
CID 82415982
4-methyl-2-pentan-2-yl-1,3-oxazole
CID 145099076
(4-methyl-1,3-oxazol-2-yl)-phenylmethanol
CID 13159069
N-[(1S)-1-(4-methyl-1,3-oxazol-2-yl)ethyl]acetamide
CID 102227163
(1S)-3-amino-1-(3-amino-1,2,4-oxadiazol-5-yl)propan-1-ol
CID 107837041
4-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]butan-2-ol
CID 106923608
[2-[(2S)-4-aminobutan-2-yl]-1,3-oxazol-4-yl]methanol
CID 10975920
3-amino-1-(5-methyl-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol
CID 107835448
3-amino-1-[3-(4-bromo-3,5-dimethylphenyl)-1,2,4-oxadiazol-5-yl]propan-1-ol
CID 107837393
ethyl 5-(3-amino-1-hydroxypropyl)-1,2,4-oxadiazole-3-carboxylate
CID 107837243

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol?
The IUPAC name of 3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol (CID 82416174) is 3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol.
What is the SMILES notation for 3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol?
The canonical SMILES for 3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol is Cc1coc(C(O)CCN)n1.
What is the InChIKey of 3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol?
The InChIKey is PXGVBQRNVKTGGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c1-5-4-11-7(9-5)6(10)2-3-8/h4,6,10H,2-3,8H2,1H3.
What are the key properties of 3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol?
3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol has a molecular weight of 156.19 g/mol, XLogP of 0.37, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(4-methyl-1,3-oxazol-2-yl)propan-1-ol is sourced from PubChem (CID 82416174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).