5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine

C14H24N2O — CID 66200058

IUPAC5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine
SMILESCC(C)Cc1c(N)noc1CC1CCCCC1
InChIInChI=1S/C14H24N2O/c1-10(2)8-12-13(17-16-14(12)15)9-11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3,(H2,15,16)
InChIKeyFGNPLBCGBASVTP-UHFFFAOYSA-N
MW236.36 g/mol
LogP3.58
Rot. Bonds4

About 5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine

5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine (PubChem CID 66200058) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine
PubChem CID66200058
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine
SMILESCC(C)Cc1c(N)noc1CC1CCCCC1
InChIInChI=1S/C14H24N2O/c1-10(2)8-12-13(17-16-14(12)15)9-11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3,(H2,15,16)
InChIKeyFGNPLBCGBASVTP-UHFFFAOYSA-N
XLogP3.58
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine?
The IUPAC name of 5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine (CID 66200058) is 5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine.
What is the SMILES notation for 5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine?
The canonical SMILES for 5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine is CC(C)Cc1c(N)noc1CC1CCCCC1.
What is the InChIKey of 5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine?
The InChIKey is FGNPLBCGBASVTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-10(2)8-12-13(17-16-14(12)15)9-11-6-4-3-5-7-11/h10-11H,3-9H2,1-2H3,(H2,15,16).
What are the key properties of 5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine?
5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine has a molecular weight of 236.36 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclohexylmethyl)-4-(2-methylpropyl)-1,2-oxazol-3-amine is sourced from PubChem (CID 66200058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).