3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol

C11H23NO — CID 130578289

IUPAC3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol
SMILESCC(N)C(C)(O)CC1(C)CCCC1
InChIInChI=1S/C11H23NO/c1-9(12)11(3,13)8-10(2)6-4-5-7-10/h9,13H,4-8,12H2,1-3H3
InChIKeyRBJJYLWWNYCEAE-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.06
Rot. Bonds3

About 3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol

3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol (PubChem CID 130578289) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol.

Molecular Properties

Compound Name3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol
PubChem CID130578289
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol
SMILESCC(N)C(C)(O)CC1(C)CCCC1
InChIInChI=1S/C11H23NO/c1-9(12)11(3,13)8-10(2)6-4-5-7-10/h9,13H,4-8,12H2,1-3H3
InChIKeyRBJJYLWWNYCEAE-UHFFFAOYSA-N
XLogP2.06
TPSA46.25 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 ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol?
The IUPAC name of 3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol (CID 130578289) is 3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol.
What is the SMILES notation for 3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol?
The canonical SMILES for 3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol is CC(N)C(C)(O)CC1(C)CCCC1.
What is the InChIKey of 3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol?
The InChIKey is RBJJYLWWNYCEAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-9(12)11(3,13)8-10(2)6-4-5-7-10/h9,13H,4-8,12H2,1-3H3.
What are the key properties of 3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol?
3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol has a molecular weight of 185.31 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methyl-1-(1-methylcyclopentyl)butan-2-ol is sourced from PubChem (CID 130578289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).