3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol

C15H23NO — CID 103270774

IUPAC3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol
SMILESCc1cc(C)cc(CNCC2CCC(O)C2)c1
InChIInChI=1S/C15H23NO/c1-11-5-12(2)7-14(6-11)10-16-9-13-3-4-15(17)8-13/h5-7,13,15-17H,3-4,8-10H2,1-2H3
InChIKeyFQFHLUDQEWIRAW-UHFFFAOYSA-N
MW233.35 g/mol
LogP2.55
Rot. Bonds4

About 3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol

3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol (PubChem CID 103270774) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol
PubChem CID103270774
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol
SMILESCc1cc(C)cc(CNCC2CCC(O)C2)c1
InChIInChI=1S/C15H23NO/c1-11-5-12(2)7-14(6-11)10-16-9-13-3-4-15(17)8-13/h5-7,13,15-17H,3-4,8-10H2,1-2H3
InChIKeyFQFHLUDQEWIRAW-UHFFFAOYSA-N
XLogP2.55
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-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

Related Compounds

3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclohexan-1-ol
CID 103699898
3-[[(3-methylphenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270659
N-[(3,5-dimethylphenyl)methyl]-1-[3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclohexyl]methanamine
CID 46231501
1-(3-chlorocyclopentyl)-N-[(3,5-dimethylphenyl)methyl]methanamine
CID 106120912
3-[[(6-methoxynaphthalen-2-yl)methylamino]methyl]cyclopentan-1-ol
CID 103270839
3-[[(4-fluorophenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270748
2-[[(3,5-dimethylphenyl)methylamino]methyl]cyclohexan-1-ol
CID 64927033
3-[[(4-methoxy-3,5-dimethylphenyl)methylamino]methyl]cyclohexan-1-ol
CID 111467497
3-[[(3-bromo-4,5-dimethoxyphenyl)methylamino]methyl]cyclopentan-1-ol
CID 103270665
3-[[[3-(methoxymethyl)phenyl]methylamino]methyl]cyclopentan-1-ol
CID 103270675
N-[(3,5-dimethylphenyl)methyl]-1-(2-methylcyclopentyl)methanamine
CID 107417631
N-[(3,5-dimethylphenyl)methyl]-1-(2-methylcyclohexyl)methanamine
CID 63456073

Frequently Asked Questions

What is the IUPAC name of 3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol (CID 103270774) is 3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol is Cc1cc(C)cc(CNCC2CCC(O)C2)c1.
What is the InChIKey of 3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol?
The InChIKey is FQFHLUDQEWIRAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-11-5-12(2)7-14(6-11)10-16-9-13-3-4-15(17)8-13/h5-7,13,15-17H,3-4,8-10H2,1-2H3.
What are the key properties of 3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol?
3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol has a molecular weight of 233.35 g/mol, XLogP of 2.55, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(3,5-dimethylphenyl)methylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 103270774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).