1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol

C12H25NO — CID 79862294

IUPAC1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol
SMILESCCC(C)(CN)C1(O)CCCC1(C)C
InChIInChI=1S/C12H25NO/c1-5-11(4,9-13)12(14)8-6-7-10(12,2)3/h14H,5-9,13H2,1-4H3
InChIKeyKORQNZHGMGEMAL-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.30
Rot. Bonds3

About 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol

1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol (PubChem CID 79862294) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol.

Molecular Properties

Compound Name1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol
PubChem CID79862294
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol
SMILESCCC(C)(CN)C1(O)CCCC1(C)C
InChIInChI=1S/C12H25NO/c1-5-11(4,9-13)12(14)8-6-7-10(12,2)3/h14H,5-9,13H2,1-4H3
InChIKeyKORQNZHGMGEMAL-UHFFFAOYSA-N
XLogP2.30
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol?
The IUPAC name of 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol (CID 79862294) is 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol.
What is the SMILES notation for 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol?
The canonical SMILES for 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol is CCC(C)(CN)C1(O)CCCC1(C)C.
What is the InChIKey of 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol?
The InChIKey is KORQNZHGMGEMAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-5-11(4,9-13)12(14)8-6-7-10(12,2)3/h14H,5-9,13H2,1-4H3.
What are the key properties of 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol?
1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol has a molecular weight of 199.34 g/mol, XLogP of 2.30, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-amino-2-methylbutan-2-yl)-2,2-dimethylcyclopentan-1-ol is sourced from PubChem (CID 79862294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).