(2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine

C14H14F2N2 — CID 82730897

IUPAC(2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine
SMILESCCc1cccnc1C(N)c1cccc(F)c1F
InChIInChI=1S/C14H14F2N2/c1-2-9-5-4-8-18-14(9)13(17)10-6-3-7-11(15)12(10)16/h3-8,13H,2,17H2,1H3
InChIKeyDRMHPXVXDLSQJK-UHFFFAOYSA-N
MW248.28 g/mol
LogP2.97
Rot. Bonds3

About (2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine

(2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine (PubChem CID 82730897) has the molecular formula C14H14F2N2 and a molecular weight of 248.28 g/mol. Its IUPAC name is (2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine.

Molecular Properties

Compound Name(2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine
PubChem CID82730897
Molecular FormulaC14H14F2N2
Molecular Weight248.28 g/mol
Exact Mass248.11
IUPAC Name(2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine
SMILESCCc1cccnc1C(N)c1cccc(F)c1F
InChIInChI=1S/C14H14F2N2/c1-2-9-5-4-8-18-14(9)13(17)10-6-3-7-11(15)12(10)16/h3-8,13H,2,17H2,1H3
InChIKeyDRMHPXVXDLSQJK-UHFFFAOYSA-N
XLogP2.97
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methyl]propan-1-amine
CID 82733064
(2-ethoxyphenyl)-(3-ethyl-2-pyridinyl)methanamine
CID 82729596
(2,3-difluorophenyl)-(3-methoxypyrazin-2-yl)methanamine
CID 105032053
(2-cyclobutylphenyl)-(3-ethyl-2-pyridinyl)methanamine
CID 114604475
(2,3-difluorophenyl)-quinolin-8-ylmethanamine
CID 105021274
(3-ethoxyphenyl)-(3-ethyl-2-pyridinyl)methanamine
CID 82729975
N-[(3-ethyl-2-pyridinyl)-(2,3,4-trifluorophenyl)methyl]ethanamine
CID 82732775
(2,4-dimethoxyphenyl)-(3-ethyl-2-pyridinyl)methanamine
CID 82729850
(3-ethyl-2-pyridinyl)-(5-fluoro-1-benzofuran-2-yl)methanamine
CID 114730701
2-ethyl-1-(3-ethyl-2-pyridinyl)butan-1-amine
CID 82729735
2-(2,3-difluorophenyl)-1-(2-methoxy-3-pyridinyl)ethanamine
CID 105137687
1-ethyl-2,3-difluorobenzene;methanamine
CID 143205868

Frequently Asked Questions

What is the IUPAC name of (2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine?
The IUPAC name of (2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine (CID 82730897) is (2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine.
What is the SMILES notation for (2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine?
The canonical SMILES for (2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine is CCc1cccnc1C(N)c1cccc(F)c1F.
What is the InChIKey of (2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine?
The InChIKey is DRMHPXVXDLSQJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2/c1-2-9-5-4-8-18-14(9)13(17)10-6-3-7-11(15)12(10)16/h3-8,13H,2,17H2,1H3.
What are the key properties of (2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine?
(2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine has a molecular weight of 248.28 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-difluorophenyl)-(3-ethyl-2-pyridinyl)methanamine is sourced from PubChem (CID 82730897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).