4-(tert-butylamino)-2,4-dimethylpentan-2-ol

C11H25NO — CID 135271245

IUPAC4-(tert-butylamino)-2,4-dimethylpentan-2-ol
SMILESCC(C)(O)CC(C)(C)NC(C)(C)C
InChIInChI=1S/C11H25NO/c1-9(2,3)12-10(4,5)8-11(6,7)13/h12-13H,8H2,1-7H3
InChIKeyAMDDLFKHKZQFCU-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.31
Rot. Bonds3

About 4-(tert-butylamino)-2,4-dimethylpentan-2-ol

4-(tert-butylamino)-2,4-dimethylpentan-2-ol (PubChem CID 135271245) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is 4-(tert-butylamino)-2,4-dimethylpentan-2-ol.

Molecular Properties

Compound Name4-(tert-butylamino)-2,4-dimethylpentan-2-ol
PubChem CID135271245
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Name4-(tert-butylamino)-2,4-dimethylpentan-2-ol
SMILESCC(C)(O)CC(C)(C)NC(C)(C)C
InChIInChI=1S/C11H25NO/c1-9(2,3)12-10(4,5)8-11(6,7)13/h12-13H,8H2,1-7H3
InChIKeyAMDDLFKHKZQFCU-UHFFFAOYSA-N
XLogP2.31
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(tert-butylamino)-2,4-dimethylpentan-2-ol?
The IUPAC name of 4-(tert-butylamino)-2,4-dimethylpentan-2-ol (CID 135271245) is 4-(tert-butylamino)-2,4-dimethylpentan-2-ol.
What is the SMILES notation for 4-(tert-butylamino)-2,4-dimethylpentan-2-ol?
The canonical SMILES for 4-(tert-butylamino)-2,4-dimethylpentan-2-ol is CC(C)(O)CC(C)(C)NC(C)(C)C.
What is the InChIKey of 4-(tert-butylamino)-2,4-dimethylpentan-2-ol?
The InChIKey is AMDDLFKHKZQFCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-9(2,3)12-10(4,5)8-11(6,7)13/h12-13H,8H2,1-7H3.
What are the key properties of 4-(tert-butylamino)-2,4-dimethylpentan-2-ol?
4-(tert-butylamino)-2,4-dimethylpentan-2-ol has a molecular weight of 187.33 g/mol, XLogP of 2.31, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(tert-butylamino)-2,4-dimethylpentan-2-ol is sourced from PubChem (CID 135271245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).