2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol

C12H23NO — CID 130555925

IUPAC2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol
SMILESCC1(C)CCC1NC1CCCC1(C)O
InChIInChI=1S/C12H23NO/c1-11(2)8-6-9(11)13-10-5-4-7-12(10,3)14/h9-10,13-14H,4-8H2,1-3H3
InChIKeyZRACOXSIUXDAPT-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.07
Rot. Bonds2

About 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol

2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol (PubChem CID 130555925) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol.

Molecular Properties

Compound Name2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol
PubChem CID130555925
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol
SMILESCC1(C)CCC1NC1CCCC1(C)O
InChIInChI=1S/C12H23NO/c1-11(2)8-6-9(11)13-10-5-4-7-12(10,3)14/h9-10,13-14H,4-8H2,1-3H3
InChIKeyZRACOXSIUXDAPT-UHFFFAOYSA-N
XLogP2.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-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 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol?
The IUPAC name of 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol (CID 130555925) is 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol.
What is the SMILES notation for 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol?
The canonical SMILES for 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol is CC1(C)CCC1NC1CCCC1(C)O.
What is the InChIKey of 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol?
The InChIKey is ZRACOXSIUXDAPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-11(2)8-6-9(11)13-10-5-4-7-12(10,3)14/h9-10,13-14H,4-8H2,1-3H3.
What are the key properties of 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol?
2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol has a molecular weight of 197.32 g/mol, XLogP of 2.07, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,2-dimethylcyclobutyl)amino]-1-methylcyclopentan-1-ol is sourced from PubChem (CID 130555925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).