4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol

C10H16N2O2 — CID 131184732

IUPAC4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol
SMILESCc1coc(NC2CCC(O)CC2)n1
InChIInChI=1S/C10H16N2O2/c1-7-6-14-10(11-7)12-8-2-4-9(13)5-3-8/h6,8-9,13H,2-5H2,1H3,(H,11,12)
InChIKeyCHOKNIRGONLFOZ-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.70
Rot. Bonds2

About 4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol

4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol (PubChem CID 131184732) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol
PubChem CID131184732
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol
SMILESCc1coc(NC2CCC(O)CC2)n1
InChIInChI=1S/C10H16N2O2/c1-7-6-14-10(11-7)12-8-2-4-9(13)5-3-8/h6,8-9,13H,2-5H2,1H3,(H,11,12)
InChIKeyCHOKNIRGONLFOZ-UHFFFAOYSA-N
XLogP1.70
TPSA58.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol?
The IUPAC name of 4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol (CID 131184732) is 4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol.
What is the SMILES notation for 4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol?
The canonical SMILES for 4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol is Cc1coc(NC2CCC(O)CC2)n1.
What is the InChIKey of 4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol?
The InChIKey is CHOKNIRGONLFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-7-6-14-10(11-7)12-8-2-4-9(13)5-3-8/h6,8-9,13H,2-5H2,1H3,(H,11,12).
What are the key properties of 4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol?
4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol has a molecular weight of 196.25 g/mol, XLogP of 1.70, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methyl-1,3-oxazol-2-yl)amino]cyclohexan-1-ol is sourced from PubChem (CID 131184732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).