3-[(cyclobutylamino)methyl]phenol

C11H15NO — CID 62416890

IUPAC3-[(cyclobutylamino)methyl]phenol
SMILESOc1cccc(CNC2CCC2)c1
InChIInChI=1S/C11H15NO/c13-11-6-1-3-9(7-11)8-12-10-4-2-5-10/h1,3,6-7,10,12-13H,2,4-5,8H2
InChIKeyOMAGUNGITIABOC-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.03
Rot. Bonds3

About 3-[(cyclobutylamino)methyl]phenol

3-[(cyclobutylamino)methyl]phenol (PubChem CID 62416890) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 3-[(cyclobutylamino)methyl]phenol.

Molecular Properties

Compound Name3-[(cyclobutylamino)methyl]phenol
PubChem CID62416890
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name3-[(cyclobutylamino)methyl]phenol
SMILESOc1cccc(CNC2CCC2)c1
InChIInChI=1S/C11H15NO/c13-11-6-1-3-9(7-11)8-12-10-4-2-5-10/h1,3,6-7,10,12-13H,2,4-5,8H2
InChIKeyOMAGUNGITIABOC-UHFFFAOYSA-N
XLogP2.03
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-[(cyclobutylamino)methyl]phenol 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-[[(4-piperidin-1-ylcyclohexyl)amino]methyl]phenol
CID 75408371
3-[[(4-propylcyclohexyl)amino]methyl]phenol
CID 54962735
3-[[[2-(chloromethyl)cyclopentyl]amino]methyl]phenol
CID 106364946
2-[4-[(3-hydroxyphenyl)methylamino]piperidin-1-yl]acetamide
CID 43746822
N-[(3-cyclopropylphenyl)methyl]cyclopentanamine
CID 79979605
3-[[(1-propylsulfonylpiperidin-4-yl)amino]methyl]phenol
CID 43747980
N-[[3-(methoxymethyl)phenyl]methyl]cyclooctanamine
CID 54896500
N-[[3-(methoxymethyl)phenyl]methyl]cyclohexanamine
CID 54896835
3-[[(2-tert-butylcyclohexyl)amino]methyl]phenol
CID 43673906
4-[(cyclopentylamino)methyl]phenol
CID 3873791
5-[(cyclobutylamino)methyl]-2-fluorophenol
CID 117221540
3-[(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ylamino)methyl]phenol
CID 43752315

Frequently Asked Questions

What is the IUPAC name of 3-[(cyclobutylamino)methyl]phenol?
The IUPAC name of 3-[(cyclobutylamino)methyl]phenol (CID 62416890) is 3-[(cyclobutylamino)methyl]phenol.
What is the SMILES notation for 3-[(cyclobutylamino)methyl]phenol?
The canonical SMILES for 3-[(cyclobutylamino)methyl]phenol is Oc1cccc(CNC2CCC2)c1.
What is the InChIKey of 3-[(cyclobutylamino)methyl]phenol?
The InChIKey is OMAGUNGITIABOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c13-11-6-1-3-9(7-11)8-12-10-4-2-5-10/h1,3,6-7,10,12-13H,2,4-5,8H2.
What are the key properties of 3-[(cyclobutylamino)methyl]phenol?
3-[(cyclobutylamino)methyl]phenol has a molecular weight of 177.25 g/mol, XLogP of 2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(cyclobutylamino)methyl]phenol is sourced from PubChem (CID 62416890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).