N-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine

C14H13F2N — CID 43424966

IUPACN-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine
SMILESFc1cccc(CNCc2ccccc2)c1F
InChIInChI=1S/C14H13F2N/c15-13-8-4-7-12(14(13)16)10-17-9-11-5-2-1-3-6-11/h1-8,17H,9-10H2
InChIKeyFJPIZBXKYUYNEI-UHFFFAOYSA-N
MW233.26 g/mol
LogP3.25
Rot. Bonds4

About N-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine

N-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine (PubChem CID 43424966) has the molecular formula C14H13F2N and a molecular weight of 233.26 g/mol. Its IUPAC name is N-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine.

Molecular Properties

Compound NameN-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine
PubChem CID43424966
Molecular FormulaC14H13F2N
Molecular Weight233.26 g/mol
Exact Mass233.10
IUPAC NameN-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine
SMILESFc1cccc(CNCc2ccccc2)c1F
InChIInChI=1S/C14H13F2N/c15-13-8-4-7-12(14(13)16)10-17-9-11-5-2-1-3-6-11/h1-8,17H,9-10H2
InChIKeyFJPIZBXKYUYNEI-UHFFFAOYSA-N
XLogP3.25
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.26
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2,3-difluorophenyl)methyl]-1-(3-fluorophenyl)methanamine
CID 43658821
1-[3-(chloromethyl)phenyl]-N-[(2,3-difluorophenyl)methyl]methanamine
CID 65024863
N-[(2,3-difluorophenyl)methyl]-1-(4-nitrophenyl)methanamine
CID 60874828
1-(2,3-difluorophenyl)-N-[[2-(methoxymethyl)phenyl]methyl]methanamine
CID 60923656
2-[(2,3-difluorophenyl)methylamino]-1-phenylethanol
CID 43425224
2-chloro-N-[(2,3-difluorophenyl)methyl]-2-phenylethanamine
CID 65026626
N-benzyl-2,3-difluoroaniline
CID 21321341
1-[(2,3-difluorophenyl)methyl]-2-phenylhydrazine
CID 169384437
N-[[2-[(2-fluorophenyl)methoxy]phenyl]methyl]-1-phenylmethanamine;hydrochloride
CID 17295917
N-[(5-bromo-2-fluorophenyl)methyl]-1-(2,3-difluorophenyl)methanamine
CID 61301397
2-[(benzylamino)methyl]phenol chloride
CID 53350489
N-benzyl-1-phenylmethanamine;hydrate
CID 173452781

Frequently Asked Questions

What is the IUPAC name of N-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine?
The IUPAC name of N-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine (CID 43424966) is N-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine.
What is the SMILES notation for N-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine?
The canonical SMILES for N-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine is Fc1cccc(CNCc2ccccc2)c1F.
What is the InChIKey of N-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine?
The InChIKey is FJPIZBXKYUYNEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2N/c15-13-8-4-7-12(14(13)16)10-17-9-11-5-2-1-3-6-11/h1-8,17H,9-10H2.
What are the key properties of N-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine?
N-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine has a molecular weight of 233.26 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,3-difluorophenyl)methyl]-1-phenylmethanamine is sourced from PubChem (CID 43424966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).