2-(tert-butylamino)-1-cyclohexylethanol

C12H25NO — CID 62772381

IUPAC2-(tert-butylamino)-1-cyclohexylethanol
SMILESCC(C)(C)NCC(O)C1CCCCC1
InChIInChI=1S/C12H25NO/c1-12(2,3)13-9-11(14)10-7-5-4-6-8-10/h10-11,13-14H,4-9H2,1-3H3
InChIKeyXMIIJEADEAIVCX-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.32
Rot. Bonds3

About 2-(tert-butylamino)-1-cyclohexylethanol

2-(tert-butylamino)-1-cyclohexylethanol (PubChem CID 62772381) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 2-(tert-butylamino)-1-cyclohexylethanol.

Molecular Properties

Compound Name2-(tert-butylamino)-1-cyclohexylethanol
PubChem CID62772381
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name2-(tert-butylamino)-1-cyclohexylethanol
SMILESCC(C)(C)NCC(O)C1CCCCC1
InChIInChI=1S/C12H25NO/c1-12(2,3)13-9-11(14)10-7-5-4-6-8-10/h10-11,13-14H,4-9H2,1-3H3
InChIKeyXMIIJEADEAIVCX-UHFFFAOYSA-N
XLogP2.32
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-1-cyclohexylethanol?
The IUPAC name of 2-(tert-butylamino)-1-cyclohexylethanol (CID 62772381) is 2-(tert-butylamino)-1-cyclohexylethanol.
What is the SMILES notation for 2-(tert-butylamino)-1-cyclohexylethanol?
The canonical SMILES for 2-(tert-butylamino)-1-cyclohexylethanol is CC(C)(C)NCC(O)C1CCCCC1.
What is the InChIKey of 2-(tert-butylamino)-1-cyclohexylethanol?
The InChIKey is XMIIJEADEAIVCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-12(2,3)13-9-11(14)10-7-5-4-6-8-10/h10-11,13-14H,4-9H2,1-3H3.
What are the key properties of 2-(tert-butylamino)-1-cyclohexylethanol?
2-(tert-butylamino)-1-cyclohexylethanol has a molecular weight of 199.34 g/mol, XLogP of 2.32, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-1-cyclohexylethanol is sourced from PubChem (CID 62772381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).