1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine

C14H14F2N2O — CID 105402628

IUPAC1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1ccc(OCc2cc(F)cc(F)c2)cn1
InChIInChI=1S/C14H14F2N2O/c1-17-7-13-2-3-14(8-18-13)19-9-10-4-11(15)6-12(16)5-10/h2-6,8,17H,7,9H2,1H3
InChIKeyQBGUIZMUYBKJSK-UHFFFAOYSA-N
MW264.28 g/mol
LogP2.66
Rot. Bonds5

About 1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine

1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine (PubChem CID 105402628) has the molecular formula C14H14F2N2O and a molecular weight of 264.28 g/mol. Its IUPAC name is 1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
PubChem CID105402628
Molecular FormulaC14H14F2N2O
Molecular Weight264.28 g/mol
Exact Mass264.11
IUPAC Name1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1ccc(OCc2cc(F)cc(F)c2)cn1
InChIInChI=1S/C14H14F2N2O/c1-17-7-13-2-3-14(8-18-13)19-9-10-4-11(15)6-12(16)5-10/h2-6,8,17H,7,9H2,1H3
InChIKeyQBGUIZMUYBKJSK-UHFFFAOYSA-N
XLogP2.66
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]methyl]ethanamine
CID 105402630
N-[[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]methyl]cyclopropanamine
CID 105402634
1-[5-[(4-chloro-3-fluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
CID 107879633
1-[5-[(5-fluoro-2-methylphenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
CID 105370370
1-[5-[(4-bromophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
CID 79775958
N-methyl-1-[5-[[3-(trifluoromethyl)phenyl]methoxy]-2-pyridinyl]methanamine
CID 79782023
1-[5-[(2-fluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine
CID 79776321
N-methyl-1-[5-(2-methylpropoxy)-2-pyridinyl]methanamine
CID 79775957
N-methyl-1-(5-prop-2-ynoxy-2-pyridinyl)methanamine
CID 79776395
N-methyl-1-[5-(quinolin-2-ylmethoxy)-2-pyridinyl]methanamine
CID 79781813
N-methyl-1-[5-[(2-methyl-1,2,4-triazol-3-yl)methoxy]-2-pyridinyl]methanamine
CID 79775503
N-[[5-[(3-chloro-4-fluorophenyl)methoxy]-2-pyridinyl]methyl]propan-2-amine
CID 103037879

Frequently Asked Questions

What is the IUPAC name of 1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine (CID 105402628) is 1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine is CNCc1ccc(OCc2cc(F)cc(F)c2)cn1.
What is the InChIKey of 1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine?
The InChIKey is QBGUIZMUYBKJSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2O/c1-17-7-13-2-3-14(8-18-13)19-9-10-4-11(15)6-12(16)5-10/h2-6,8,17H,7,9H2,1H3.
What are the key properties of 1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine?
1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine has a molecular weight of 264.28 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[(3,5-difluorophenyl)methoxy]-2-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 105402628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).