3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine

C9H11FN2 — CID 169473093

IUPAC3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine
SMILESCNCC=Cc1cc(F)ccn1
InChIInChI=1S/C9H11FN2/c1-11-5-2-3-9-7-8(10)4-6-12-9/h2-4,6-7,11H,5H2,1H3
InChIKeyIFROCMBGDHKDKC-UHFFFAOYSA-N
MW166.20 g/mol
LogP1.45
Rot. Bonds3

About 3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine

3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine (PubChem CID 169473093) has the molecular formula C9H11FN2 and a molecular weight of 166.20 g/mol. Its IUPAC name is 3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine.

Molecular Properties

Compound Name3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine
PubChem CID169473093
Molecular FormulaC9H11FN2
Molecular Weight166.20 g/mol
Exact Mass166.09
IUPAC Name3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine
SMILESCNCC=Cc1cc(F)ccn1
InChIInChI=1S/C9H11FN2/c1-11-5-2-3-9-7-8(10)4-6-12-9/h2-4,6-7,11H,5H2,1H3
InChIKeyIFROCMBGDHKDKC-UHFFFAOYSA-N
XLogP1.45
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-fluoro-2-pyridinyl)prop-2-en-1-ol
CID 169452872
3-cyclopropyl-2-[(E)-2-(4-fluoro-2-pyridinyl)ethenyl]-N-methylaniline
CID 144838169
3-(2-chloro-4-fluorophenyl)-N-methylprop-2-en-1-amine
CID 169473168
(4-fluoro-2-pyridinyl)-trimethylstannane
CID 157030124
3-(4-fluoro-2,6-dimethylphenyl)-N-methylprop-2-en-1-amine
CID 169473419
N-[3-(2-fluoro-4-pyridinyl)prop-2-enyl]acetamide
CID 169464909
2-fluoro-4-[3-(methylamino)prop-1-enyl]phenol
CID 169473192
4-methyl-2-[(E)-pent-1-enyl]pyridine
CID 59772955
6-[3-(methylamino)prop-1-enyl]pyridine-2-carbaldehyde
CID 169473370
N-methyl-3-(5-nitro-2-pyridinyl)prop-2-en-1-amine
CID 169473566
N-[3-(5-fluoro-2-pyridinyl)prop-2-enyl]acetamide
CID 169464899
4-(2-chloro-4-pyridinyl)-N-methylbut-3-en-1-amine
CID 170495263

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine?
The IUPAC name of 3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine (CID 169473093) is 3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine.
What is the SMILES notation for 3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine?
The canonical SMILES for 3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine is CNCC=Cc1cc(F)ccn1.
What is the InChIKey of 3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine?
The InChIKey is IFROCMBGDHKDKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11FN2/c1-11-5-2-3-9-7-8(10)4-6-12-9/h2-4,6-7,11H,5H2,1H3.
What are the key properties of 3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine?
3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine has a molecular weight of 166.20 g/mol, XLogP of 1.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluoro-2-pyridinyl)-N-methylprop-2-en-1-amine is sourced from PubChem (CID 169473093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).