2-(cyclobutylmethylamino)-4-methylpentan-1-ol

C11H23NO — CID 65458956

IUPAC2-(cyclobutylmethylamino)-4-methylpentan-1-ol
SMILESCC(C)CC(CO)NCC1CCC1
InChIInChI=1S/C11H23NO/c1-9(2)6-11(8-13)12-7-10-4-3-5-10/h9-13H,3-8H2,1-2H3
InChIKeyLIMCKVRGGQKVTI-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.78
Rot. Bonds6

About 2-(cyclobutylmethylamino)-4-methylpentan-1-ol

2-(cyclobutylmethylamino)-4-methylpentan-1-ol (PubChem CID 65458956) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 2-(cyclobutylmethylamino)-4-methylpentan-1-ol.

Molecular Properties

Compound Name2-(cyclobutylmethylamino)-4-methylpentan-1-ol
PubChem CID65458956
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name2-(cyclobutylmethylamino)-4-methylpentan-1-ol
SMILESCC(C)CC(CO)NCC1CCC1
InChIInChI=1S/C11H23NO/c1-9(2)6-11(8-13)12-7-10-4-3-5-10/h9-13H,3-8H2,1-2H3
InChIKeyLIMCKVRGGQKVTI-UHFFFAOYSA-N
XLogP1.78
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
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 2-(cyclobutylmethylamino)-4-methylpentan-1-ol?
The IUPAC name of 2-(cyclobutylmethylamino)-4-methylpentan-1-ol (CID 65458956) is 2-(cyclobutylmethylamino)-4-methylpentan-1-ol.
What is the SMILES notation for 2-(cyclobutylmethylamino)-4-methylpentan-1-ol?
The canonical SMILES for 2-(cyclobutylmethylamino)-4-methylpentan-1-ol is CC(C)CC(CO)NCC1CCC1.
What is the InChIKey of 2-(cyclobutylmethylamino)-4-methylpentan-1-ol?
The InChIKey is LIMCKVRGGQKVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-9(2)6-11(8-13)12-7-10-4-3-5-10/h9-13H,3-8H2,1-2H3.
What are the key properties of 2-(cyclobutylmethylamino)-4-methylpentan-1-ol?
2-(cyclobutylmethylamino)-4-methylpentan-1-ol has a molecular weight of 185.31 g/mol, XLogP of 1.78, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclobutylmethylamino)-4-methylpentan-1-ol is sourced from PubChem (CID 65458956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).