N-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine

C16H28N2O — CID 107185149

IUPACN-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCCc1ncc(C2CCCC2(C)C)o1
InChIInChI=1S/C16H28N2O/c1-15(2,3)18-10-8-14-17-11-13(19-14)12-7-6-9-16(12,4)5/h11-12,18H,6-10H2,1-5H3
InChIKeyWRGBTQIHUDLECJ-UHFFFAOYSA-N
MW264.41 g/mol
LogP3.90
Rot. Bonds4

About N-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine

N-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine (PubChem CID 107185149) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is N-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine
PubChem CID107185149
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC NameN-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCCc1ncc(C2CCCC2(C)C)o1
InChIInChI=1S/C16H28N2O/c1-15(2,3)18-10-8-14-17-11-13(19-14)12-7-6-9-16(12,4)5/h11-12,18H,6-10H2,1-5H3
InChIKeyWRGBTQIHUDLECJ-UHFFFAOYSA-N
XLogP3.90
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine?
The IUPAC name of N-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine (CID 107185149) is N-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine is CC(C)(C)NCCc1ncc(C2CCCC2(C)C)o1.
What is the InChIKey of N-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine?
The InChIKey is WRGBTQIHUDLECJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-15(2,3)18-10-8-14-17-11-13(19-14)12-7-6-9-16(12,4)5/h11-12,18H,6-10H2,1-5H3.
What are the key properties of N-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine?
N-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine has a molecular weight of 264.41 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[5-(2,2-dimethylcyclopentyl)-1,3-oxazol-2-yl]ethyl]-2-methylpropan-2-amine is sourced from PubChem (CID 107185149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).