3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol

C8H14N2O3 — CID 106371905

IUPAC3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol
SMILESCc1cnc(CNCC(O)CO)o1
InChIInChI=1S/C8H14N2O3/c1-6-2-10-8(13-6)4-9-3-7(12)5-11/h2,7,9,11-12H,3-5H2,1H3
InChIKeyMXRKASXZPVDSDY-UHFFFAOYSA-N
MW186.21 g/mol
LogP-0.57
Rot. Bonds5

About 3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol

3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol (PubChem CID 106371905) has the molecular formula C8H14N2O3 and a molecular weight of 186.21 g/mol. Its IUPAC name is 3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol.

Molecular Properties

Compound Name3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol
PubChem CID106371905
Molecular FormulaC8H14N2O3
Molecular Weight186.21 g/mol
Exact Mass186.10
IUPAC Name3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol
SMILESCc1cnc(CNCC(O)CO)o1
InChIInChI=1S/C8H14N2O3/c1-6-2-10-8(13-6)4-9-3-7(12)5-11/h2,7,9,11-12H,3-5H2,1H3
InChIKeyMXRKASXZPVDSDY-UHFFFAOYSA-N
XLogP-0.57
TPSA78.52 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 5-0.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-methoxyphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol
CID 106372231
1-[(5-methyl-1,3-oxazol-2-yl)methylamino]-3-octoxypropan-2-ol
CID 106371765
2-amino-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propanoic acid
CID 106373556
3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-1-ol
CID 106371738
1-(2-bromo-4-methylphenoxy)-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propan-2-ol
CID 106371950
N'-hydroxy-2-methyl-3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propanimidamide
CID 106372798
1-cyclopropyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine
CID 103275583
2-[(5-methyl-1,3-oxazol-2-yl)methylamino]-1-[4-(trifluoromethyl)phenyl]ethanol
CID 106371948
1-(3,4-difluorophenyl)-2-[(5-methyl-1,3-oxazol-2-yl)methylamino]ethanol
CID 106371980
2-[(5-methyl-1,3-oxazol-2-yl)methylamino]acetic acid
CID 106372016
2-[(5-methyl-1,3-oxazol-2-yl)methylamino]-N-propan-2-ylacetamide
CID 106372389
3-[(3-methyl-1,2-oxazol-5-yl)methylamino]propane-1,2-diol
CID 76926965

Frequently Asked Questions

What is the IUPAC name of 3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol?
The IUPAC name of 3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol (CID 106371905) is 3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol.
What is the SMILES notation for 3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol?
The canonical SMILES for 3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol is Cc1cnc(CNCC(O)CO)o1.
What is the InChIKey of 3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol?
The InChIKey is MXRKASXZPVDSDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O3/c1-6-2-10-8(13-6)4-9-3-7(12)5-11/h2,7,9,11-12H,3-5H2,1H3.
What are the key properties of 3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol?
3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol has a molecular weight of 186.21 g/mol, XLogP of -0.57, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-methyl-1,3-oxazol-2-yl)methylamino]propane-1,2-diol is sourced from PubChem (CID 106371905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).