4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol

C11H20N2O2 — CID 106349259

IUPAC4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol
SMILESCC(C)(C)C(CCO)NCc1cnco1
InChIInChI=1S/C11H20N2O2/c1-11(2,3)10(4-5-14)13-7-9-6-12-8-15-9/h6,8,10,13-14H,4-5,7H2,1-3H3
InChIKeyJMIQPEGRDQLILK-UHFFFAOYSA-N
MW212.29 g/mol
LogP1.56
Rot. Bonds5

About 4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol

4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol (PubChem CID 106349259) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is 4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol.

Molecular Properties

Compound Name4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol
PubChem CID106349259
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC Name4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol
SMILESCC(C)(C)C(CCO)NCc1cnco1
InChIInChI=1S/C11H20N2O2/c1-11(2,3)10(4-5-14)13-7-9-6-12-8-15-9/h6,8,10,13-14H,4-5,7H2,1-3H3
InChIKeyJMIQPEGRDQLILK-UHFFFAOYSA-N
XLogP1.56
TPSA58.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,3-oxazol-5-ylmethyl)propan-2-amine
CID 58786923
3-[(3-ethylimidazol-4-yl)methylamino]-4,4-dimethylpentan-1-ol
CID 106348886
3-(benzylamino)-4,4-dimethylpentan-1-ol
CID 103949930
4,4-dimethyl-3-(pyrimidin-4-ylmethylamino)pentan-1-ol
CID 106348940
4,4-dimethyl-3-[(6-methyl-3-pyridinyl)methylamino]pentan-1-ol
CID 114176802
4,4-dimethyl-3-[(5-methylpyrimidin-2-yl)amino]pentan-1-ol
CID 103858207
3-(isoquinolin-6-ylmethylamino)-4,4-dimethylpentan-1-ol
CID 106349273
3-[(4-fluorophenyl)methylamino]-4,4-dimethylpentan-1-ol
CID 103949872
3-[(5-aminopyrimidin-4-yl)amino]-4,4-dimethylpentan-1-ol
CID 106348369
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethylamino)-4,4-dimethylpentan-1-ol
CID 106348863
3-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylamino]-4,4-dimethylpentan-1-ol
CID 103949908
3-(2,2-dimethylpropylamino)-4,4-dimethylpentan-1-ol
CID 106348997

Frequently Asked Questions

What is the IUPAC name of 4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol?
The IUPAC name of 4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol (CID 106349259) is 4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol.
What is the SMILES notation for 4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol?
The canonical SMILES for 4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol is CC(C)(C)C(CCO)NCc1cnco1.
What is the InChIKey of 4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol?
The InChIKey is JMIQPEGRDQLILK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-11(2,3)10(4-5-14)13-7-9-6-12-8-15-9/h6,8,10,13-14H,4-5,7H2,1-3H3.
What are the key properties of 4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol?
4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol has a molecular weight of 212.29 g/mol, XLogP of 1.56, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-dimethyl-3-(1,3-oxazol-5-ylmethylamino)pentan-1-ol is sourced from PubChem (CID 106349259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).