[3-[(tert-butylamino)methyl]cyclopentyl]methanol

C11H23NO — CID 59314593

IUPAC[3-[(tert-butylamino)methyl]cyclopentyl]methanol
SMILESCC(C)(C)NCC1CCC(CO)C1
InChIInChI=1S/C11H23NO/c1-11(2,3)12-7-9-4-5-10(6-9)8-13/h9-10,12-13H,4-8H2,1-3H3
InChIKeyGELATYMNKQWKMT-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.78
Rot. Bonds3

About [3-[(tert-butylamino)methyl]cyclopentyl]methanol

[3-[(tert-butylamino)methyl]cyclopentyl]methanol (PubChem CID 59314593) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is [3-[(tert-butylamino)methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[3-[(tert-butylamino)methyl]cyclopentyl]methanol
PubChem CID59314593
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name[3-[(tert-butylamino)methyl]cyclopentyl]methanol
SMILESCC(C)(C)NCC1CCC(CO)C1
InChIInChI=1S/C11H23NO/c1-11(2,3)12-7-9-4-5-10(6-9)8-13/h9-10,12-13H,4-8H2,1-3H3
InChIKeyGELATYMNKQWKMT-UHFFFAOYSA-N
XLogP1.78
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [3-[(tert-butylamino)methyl]cyclopentyl]methanol?
The IUPAC name of [3-[(tert-butylamino)methyl]cyclopentyl]methanol (CID 59314593) is [3-[(tert-butylamino)methyl]cyclopentyl]methanol.
What is the SMILES notation for [3-[(tert-butylamino)methyl]cyclopentyl]methanol?
The canonical SMILES for [3-[(tert-butylamino)methyl]cyclopentyl]methanol is CC(C)(C)NCC1CCC(CO)C1.
What is the InChIKey of [3-[(tert-butylamino)methyl]cyclopentyl]methanol?
The InChIKey is GELATYMNKQWKMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-11(2,3)12-7-9-4-5-10(6-9)8-13/h9-10,12-13H,4-8H2,1-3H3.
What are the key properties of [3-[(tert-butylamino)methyl]cyclopentyl]methanol?
[3-[(tert-butylamino)methyl]cyclopentyl]methanol has a molecular weight of 185.31 g/mol, XLogP of 1.78, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(tert-butylamino)methyl]cyclopentyl]methanol is sourced from PubChem (CID 59314593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).