5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine

C11H19N3O — CID 117038942

IUPAC5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine
SMILESCN(Cc1cc(N)no1)C1CCCCC1
InChIInChI=1S/C11H19N3O/c1-14(9-5-3-2-4-6-9)8-10-7-11(12)13-15-10/h7,9H,2-6,8H2,1H3,(H2,12,13)
InChIKeyUFRVMNZPTPURMD-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.02
Rot. Bonds3

About 5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine

5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine (PubChem CID 117038942) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine
PubChem CID117038942
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine
SMILESCN(Cc1cc(N)no1)C1CCCCC1
InChIInChI=1S/C11H19N3O/c1-14(9-5-3-2-4-6-9)8-10-7-11(12)13-15-10/h7,9H,2-6,8H2,1H3,(H2,12,13)
InChIKeyUFRVMNZPTPURMD-UHFFFAOYSA-N
XLogP2.02
TPSA55.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine?
The IUPAC name of 5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine (CID 117038942) is 5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine.
What is the SMILES notation for 5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine?
The canonical SMILES for 5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine is CN(Cc1cc(N)no1)C1CCCCC1.
What is the InChIKey of 5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine?
The InChIKey is UFRVMNZPTPURMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-14(9-5-3-2-4-6-9)8-10-7-11(12)13-15-10/h7,9H,2-6,8H2,1H3,(H2,12,13).
What are the key properties of 5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine?
5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine has a molecular weight of 209.29 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[cyclohexyl(methyl)amino]methyl]-1,2-oxazol-3-amine is sourced from PubChem (CID 117038942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).