N-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine

C14H24N2O — CID 106829209

IUPACN-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine
SMILESCC(C)NCc1ncc(C2(C)CCCCC2)o1
InChIInChI=1S/C14H24N2O/c1-11(2)15-10-13-16-9-12(17-13)14(3)7-5-4-6-8-14/h9,11,15H,4-8,10H2,1-3H3
InChIKeyDVMLOXAFSGAIKD-UHFFFAOYSA-N
MW236.36 g/mol
LogP3.39
Rot. Bonds4

About N-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine

N-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine (PubChem CID 106829209) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is N-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine
PubChem CID106829209
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC NameN-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine
SMILESCC(C)NCc1ncc(C2(C)CCCCC2)o1
InChIInChI=1S/C14H24N2O/c1-11(2)15-10-13-16-9-12(17-13)14(3)7-5-4-6-8-14/h9,11,15H,4-8,10H2,1-3H3
InChIKeyDVMLOXAFSGAIKD-UHFFFAOYSA-N
XLogP3.39
TPSA38.06 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 ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine?
The IUPAC name of N-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine (CID 106829209) is N-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine is CC(C)NCc1ncc(C2(C)CCCCC2)o1.
What is the InChIKey of N-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine?
The InChIKey is DVMLOXAFSGAIKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-11(2)15-10-13-16-9-12(17-13)14(3)7-5-4-6-8-14/h9,11,15H,4-8,10H2,1-3H3.
What are the key properties of N-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine?
N-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine has a molecular weight of 236.36 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(1-methylcyclohexyl)-1,3-oxazol-2-yl]methyl]propan-2-amine is sourced from PubChem (CID 106829209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).