1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine

C14H27NO — CID 114622245

IUPAC1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine
SMILESCC1(C)CC(C2(N)CCCCC2)C(C)(C)O1
InChIInChI=1S/C14H27NO/c1-12(2)10-11(13(3,4)16-12)14(15)8-6-5-7-9-14/h11H,5-10,15H2,1-4H3
InChIKeyHLQIZTDIIKVLHD-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.24
Rot. Bonds1

About 1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine

1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine (PubChem CID 114622245) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine
PubChem CID114622245
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine
SMILESCC1(C)CC(C2(N)CCCCC2)C(C)(C)O1
InChIInChI=1S/C14H27NO/c1-12(2)10-11(13(3,4)16-12)14(15)8-6-5-7-9-14/h11H,5-10,15H2,1-4H3
InChIKeyHLQIZTDIIKVLHD-UHFFFAOYSA-N
XLogP3.24
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine?
The IUPAC name of 1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine (CID 114622245) is 1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine.
What is the SMILES notation for 1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine?
The canonical SMILES for 1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine is CC1(C)CC(C2(N)CCCCC2)C(C)(C)O1.
What is the InChIKey of 1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine?
The InChIKey is HLQIZTDIIKVLHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-12(2)10-11(13(3,4)16-12)14(15)8-6-5-7-9-14/h11H,5-10,15H2,1-4H3.
What are the key properties of 1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine?
1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine has a molecular weight of 225.38 g/mol, XLogP of 3.24, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-amine is sourced from PubChem (CID 114622245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).