3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine

C17H18FNO — CID 82709787

IUPAC3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine
SMILESFc1ccccc1C1CC(NOCc2ccccc2)C1
InChIInChI=1S/C17H18FNO/c18-17-9-5-4-8-16(17)14-10-15(11-14)19-20-12-13-6-2-1-3-7-13/h1-9,14-15,19H,10-12H2
InChIKeyCOJCKTUPEQKGIO-UHFFFAOYSA-N
MW271.34 g/mol
LogP3.79
Rot. Bonds5

About 3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine

3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine (PubChem CID 82709787) has the molecular formula C17H18FNO and a molecular weight of 271.34 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine.

Molecular Properties

Compound Name3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine
PubChem CID82709787
Molecular FormulaC17H18FNO
Molecular Weight271.34 g/mol
Exact Mass271.14
IUPAC Name3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine
SMILESFc1ccccc1C1CC(NOCc2ccccc2)C1
InChIInChI=1S/C17H18FNO/c18-17-9-5-4-8-16(17)14-10-15(11-14)19-20-12-13-6-2-1-3-7-13/h1-9,14-15,19H,10-12H2
InChIKeyCOJCKTUPEQKGIO-UHFFFAOYSA-N
XLogP3.79
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine 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

3,5-dimethyl-N-phenylmethoxycyclohexan-1-amine
CID 64974306
N-(cyclohexylmethyl)-3-(2-fluorophenyl)cyclobutan-1-amine
CID 43635354
3-(2-fluorophenyl)-N-(7-methyloctyl)cyclobutan-1-amine
CID 43634781
N-phenylmethoxy-2,3-dihydro-1H-inden-1-amine
CID 82710227
N-[3-(2-fluorophenyl)cyclobutyl]cyclooctanamine
CID 43633190
3-methyl-N-phenylmethoxycyclohexan-1-amine
CID 64974323
4-[[3-(2-fluorophenyl)cyclobutyl]carbamoylamino]butanoic acid
CID 122012972
3-[[[3-(2-fluorophenyl)cyclobutyl]amino]methyl]benzonitrile
CID 60919127
5-fluoro-N-phenylmethoxy-2,3-dihydro-1H-inden-1-amine
CID 116531102
1-N,2-N-bis(phenylmethoxy)cyclohexane-1,2-diamine
CID 3839523
5-chloro-N-phenylmethoxy-2,3-dihydro-1H-inden-2-amine
CID 82709693
N-phenylmethoxyadamantan-2-amine
CID 15552592

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine?
The IUPAC name of 3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine (CID 82709787) is 3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine.
What is the SMILES notation for 3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine?
The canonical SMILES for 3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine is Fc1ccccc1C1CC(NOCc2ccccc2)C1.
What is the InChIKey of 3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine?
The InChIKey is COJCKTUPEQKGIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO/c18-17-9-5-4-8-16(17)14-10-15(11-14)19-20-12-13-6-2-1-3-7-13/h1-9,14-15,19H,10-12H2.
What are the key properties of 3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine?
3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine has a molecular weight of 271.34 g/mol, XLogP of 3.79, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-N-phenylmethoxycyclobutan-1-amine is sourced from PubChem (CID 82709787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).