1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine

C15H17FN2 — CID 62997398

IUPAC1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine
SMILESCc1ccc(CNC(C)c2ccccc2F)cn1
InChIInChI=1S/C15H17FN2/c1-11-7-8-13(9-17-11)10-18-12(2)14-5-3-4-6-15(14)16/h3-9,12,18H,10H2,1-2H3
InChIKeyDZJJYJBDHVHIAF-UHFFFAOYSA-N
MW244.31 g/mol
LogP3.38
Rot. Bonds4

About 1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine

1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine (PubChem CID 62997398) has the molecular formula C15H17FN2 and a molecular weight of 244.31 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine
PubChem CID62997398
Molecular FormulaC15H17FN2
Molecular Weight244.31 g/mol
Exact Mass244.14
IUPAC Name1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine
SMILESCc1ccc(CNC(C)c2ccccc2F)cn1
InChIInChI=1S/C15H17FN2/c1-11-7-8-13(9-17-11)10-18-12(2)14-5-3-4-6-15(14)16/h3-9,12,18H,10H2,1-2H3
InChIKeyDZJJYJBDHVHIAF-UHFFFAOYSA-N
XLogP3.38
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.31
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chlorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine
CID 55139743
1-(2,3-dichlorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine
CID 103777778
N-[(3-fluoro-4-methylphenyl)methyl]-1-(2-fluorophenyl)ethanamine
CID 63646240
N-[(4-bromophenyl)methyl]-1-(2-fluorophenyl)ethanamine
CID 60659010
1-(2-fluorophenyl)-N-[(5-methyl-2-pyridinyl)methyl]ethanamine
CID 80708851
1-(2-fluorophenyl)-N-[(3,4,5-trifluorophenyl)methyl]ethanamine
CID 63051050
(1R)-1-(2-fluorophenyl)-N-[[4-(methoxymethyl)phenyl]methyl]ethanamine
CID 81380322
1-(2-fluorophenyl)-N-[(4-propan-2-yloxyphenyl)methyl]ethanamine
CID 60928300
4-[[1-(2-fluorophenyl)ethylamino]methyl]benzene-1,2-diol
CID 60664100
1-(2-fluorophenyl)-N-[(4-propoxyphenyl)methyl]ethanamine
CID 60659012
1-(2,5-dimethoxyphenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine
CID 62994899
N-[(2,6-difluorophenyl)methyl]-1-(2-fluorophenyl)ethanamine
CID 60659047

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine?
The IUPAC name of 1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine (CID 62997398) is 1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine.
What is the SMILES notation for 1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine?
The canonical SMILES for 1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine is Cc1ccc(CNC(C)c2ccccc2F)cn1.
What is the InChIKey of 1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine?
The InChIKey is DZJJYJBDHVHIAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2/c1-11-7-8-13(9-17-11)10-18-12(2)14-5-3-4-6-15(14)16/h3-9,12,18H,10H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine?
1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine has a molecular weight of 244.31 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-[(6-methyl-3-pyridinyl)methyl]ethanamine is sourced from PubChem (CID 62997398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).