2-(tert-butylamino)adamantan-1-ol

C14H25NO — CID 59574304

IUPAC2-(tert-butylamino)adamantan-1-ol
SMILESCC(C)(C)NC1C2CC3CC(C2)CC1(O)C3
InChIInChI=1S/C14H25NO/c1-13(2,3)15-12-11-5-9-4-10(6-11)8-14(12,16)7-9/h9-12,15-16H,4-8H2,1-3H3
InChIKeyFZDJBCVXWSZESW-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.31
Rot. Bonds1

About 2-(tert-butylamino)adamantan-1-ol

2-(tert-butylamino)adamantan-1-ol (PubChem CID 59574304) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 2-(tert-butylamino)adamantan-1-ol.

Molecular Properties

Compound Name2-(tert-butylamino)adamantan-1-ol
PubChem CID59574304
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name2-(tert-butylamino)adamantan-1-ol
SMILESCC(C)(C)NC1C2CC3CC(C2)CC1(O)C3
InChIInChI=1S/C14H25NO/c1-13(2,3)15-12-11-5-9-4-10(6-11)8-14(12,16)7-9/h9-12,15-16H,4-8H2,1-3H3
InChIKeyFZDJBCVXWSZESW-UHFFFAOYSA-N
XLogP2.31
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)adamantan-1-ol?
The IUPAC name of 2-(tert-butylamino)adamantan-1-ol (CID 59574304) is 2-(tert-butylamino)adamantan-1-ol.
What is the SMILES notation for 2-(tert-butylamino)adamantan-1-ol?
The canonical SMILES for 2-(tert-butylamino)adamantan-1-ol is CC(C)(C)NC1C2CC3CC(C2)CC1(O)C3.
What is the InChIKey of 2-(tert-butylamino)adamantan-1-ol?
The InChIKey is FZDJBCVXWSZESW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-13(2,3)15-12-11-5-9-4-10(6-11)8-14(12,16)7-9/h9-12,15-16H,4-8H2,1-3H3.
What are the key properties of 2-(tert-butylamino)adamantan-1-ol?
2-(tert-butylamino)adamantan-1-ol has a molecular weight of 223.36 g/mol, XLogP of 2.31, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)adamantan-1-ol is sourced from PubChem (CID 59574304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).