1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine

C16H19FN2 — CID 114829687

IUPAC1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine
SMILESCc1cccc(CNC(C)Cc2ccccc2F)n1
InChIInChI=1S/C16H19FN2/c1-12-6-5-8-15(19-12)11-18-13(2)10-14-7-3-4-9-16(14)17/h3-9,13,18H,10-11H2,1-2H3
InChIKeyUEHMMCGHXBBBQV-UHFFFAOYSA-N
MW258.34 g/mol
LogP3.25
Rot. Bonds5

About 1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine

1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine (PubChem CID 114829687) has the molecular formula C16H19FN2 and a molecular weight of 258.34 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine
PubChem CID114829687
Molecular FormulaC16H19FN2
Molecular Weight258.34 g/mol
Exact Mass258.15
IUPAC Name1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine
SMILESCc1cccc(CNC(C)Cc2ccccc2F)n1
InChIInChI=1S/C16H19FN2/c1-12-6-5-8-15(19-12)11-18-13(2)10-14-7-3-4-9-16(14)17/h3-9,13,18H,10-11H2,1-2H3
InChIKeyUEHMMCGHXBBBQV-UHFFFAOYSA-N
XLogP3.25
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.34
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,1-N-dimethyl-2-N-[(6-methyl-2-pyridinyl)methyl]propane-1,2-diamine
CID 82939144
1-(2-fluorophenyl)-N-[(3-fluorophenyl)methyl]propan-2-amine
CID 115592338
(1R)-1-(4-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]ethanamine
CID 81347820
4-methyl-N-[(6-methyl-2-pyridinyl)methyl]-4-phenylpentan-2-amine
CID 62323185
N-[(3-chlorophenyl)methyl]-1-(2-fluorophenyl)propan-2-amine
CID 115592336
N-[(6-methyl-2-pyridinyl)methyl]-1-pyridin-2-ylethanamine
CID 62321588
4-[3-[(6-methyl-2-pyridinyl)methylamino]butyl]phenol
CID 62322123
3,3-dimethyl-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine
CID 115710700
1-(2-fluorophenyl)-N-prop-2-enylpropan-2-amine
CID 114827813
(2S)-1-(2-fluorophenyl)-N-[(2-methyl-1,2,4-triazol-3-yl)methyl]propan-2-amine
CID 124620014
1-bromo-N-[(2-fluorophenyl)methyl]propan-2-amine
CID 107859641
1-(4-bromophenyl)-N-[(2-fluorophenyl)methyl]propan-2-amine
CID 43696028

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine?
The IUPAC name of 1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine (CID 114829687) is 1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine.
What is the SMILES notation for 1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine?
The canonical SMILES for 1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine is Cc1cccc(CNC(C)Cc2ccccc2F)n1.
What is the InChIKey of 1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine?
The InChIKey is UEHMMCGHXBBBQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN2/c1-12-6-5-8-15(19-12)11-18-13(2)10-14-7-3-4-9-16(14)17/h3-9,13,18H,10-11H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine?
1-(2-fluorophenyl)-N-[(6-methyl-2-pyridinyl)methyl]propan-2-amine has a molecular weight of 258.34 g/mol, XLogP of 3.25, 5 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-2-pyridinyl)methyl]propan-2-amine is sourced from PubChem (CID 114829687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).