N-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine

C13H18F2N2O — CID 83007673

IUPACN-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine
SMILESFC(F)Oc1ccccc1CNN1CCCCC1
InChIInChI=1S/C13H18F2N2O/c14-13(15)18-12-7-3-2-6-11(12)10-16-17-8-4-1-5-9-17/h2-3,6-7,13,16H,1,4-5,8-10H2
InChIKeyGOPLBZVTQBUJSM-UHFFFAOYSA-N
MW256.30 g/mol
LogP2.78
Rot. Bonds5

About N-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine

N-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine (PubChem CID 83007673) has the molecular formula C13H18F2N2O and a molecular weight of 256.30 g/mol. Its IUPAC name is N-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine.

Molecular Properties

Compound NameN-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine
PubChem CID83007673
Molecular FormulaC13H18F2N2O
Molecular Weight256.30 g/mol
Exact Mass256.14
IUPAC NameN-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine
SMILESFC(F)Oc1ccccc1CNN1CCCCC1
InChIInChI=1S/C13H18F2N2O/c14-13(15)18-12-7-3-2-6-11(12)10-16-17-8-4-1-5-9-17/h2-3,6-7,13,16H,1,4-5,8-10H2
InChIKeyGOPLBZVTQBUJSM-UHFFFAOYSA-N
XLogP2.78
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[2-(difluoromethoxy)phenyl]methyl]piperidin-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

N-[[2-(trifluoromethoxy)phenyl]methyl]piperidin-1-amine
CID 83006472
N-[(2-propan-2-yloxyphenyl)methyl]morpholin-4-amine
CID 83011368
1-cyclobutyl-N-[[2-(difluoromethoxy)phenyl]methyl]methanamine
CID 43298345
1-[2-(difluoromethoxy)phenyl]-N-methoxymethanamine
CID 115280691
2-[[2-(difluoromethoxy)phenyl]methylamino]-2-(hydroxymethyl)propane-1,3-diol
CID 107850513
N-[[2-(difluoromethoxy)phenyl]methyl]butan-2-amine
CID 43177333
N-[1-[2-(difluoromethoxy)phenyl]ethyl]piperidin-1-amine
CID 83006799
N-[[2-(difluoromethoxy)phenyl]methyl]-2-piperidin-1-ylpyridine-3-carboxamide
CID 86998055
1-[2-(difluoromethoxy)phenyl]-N-(2-methoxyethoxy)methanamine
CID 82715760
N-[[2-(difluoromethoxy)phenyl]methyl]-1-(1-methylpyrrolidin-3-yl)methanamine
CID 60855904
N-[[2-(difluoromethoxy)phenyl]methyl]-2-methylcyclopentan-1-amine
CID 63277687
N-[[2-(difluoromethoxy)phenyl]methyl]-2-methyl-1-thiophen-2-ylpropan-1-amine
CID 43225866

Frequently Asked Questions

What is the IUPAC name of N-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine?
The IUPAC name of N-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine (CID 83007673) is N-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine.
What is the SMILES notation for N-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine?
The canonical SMILES for N-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine is FC(F)Oc1ccccc1CNN1CCCCC1.
What is the InChIKey of N-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine?
The InChIKey is GOPLBZVTQBUJSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18F2N2O/c14-13(15)18-12-7-3-2-6-11(12)10-16-17-8-4-1-5-9-17/h2-3,6-7,13,16H,1,4-5,8-10H2.
What are the key properties of N-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine?
N-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine has a molecular weight of 256.30 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(difluoromethoxy)phenyl]methyl]piperidin-1-amine is sourced from PubChem (CID 83007673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).