[1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol

C14H24N2O2 — CID 103966545

IUPAC[1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol
SMILESCc1nc(CNCC2(CO)CCCCC2)oc1C
InChIInChI=1S/C14H24N2O2/c1-11-12(2)18-13(16-11)8-15-9-14(10-17)6-4-3-5-7-14/h15,17H,3-10H2,1-2H3
InChIKeyZYMZDFKKKPFLPB-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.32
Rot. Bonds5

About [1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol

[1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol (PubChem CID 103966545) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is [1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol
PubChem CID103966545
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name[1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol
SMILESCc1nc(CNCC2(CO)CCCCC2)oc1C
InChIInChI=1S/C14H24N2O2/c1-11-12(2)18-13(16-11)8-15-9-14(10-17)6-4-3-5-7-14/h15,17H,3-10H2,1-2H3
InChIKeyZYMZDFKKKPFLPB-UHFFFAOYSA-N
XLogP2.32
TPSA58.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol?
The IUPAC name of [1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol (CID 103966545) is [1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol is Cc1nc(CNCC2(CO)CCCCC2)oc1C.
What is the InChIKey of [1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol?
The InChIKey is ZYMZDFKKKPFLPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-11-12(2)18-13(16-11)8-15-9-14(10-17)6-4-3-5-7-14/h15,17H,3-10H2,1-2H3.
What are the key properties of [1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol?
[1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol has a molecular weight of 252.36 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 103966545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).