5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine

C16H20FN3 — CID 62209615

IUPAC5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine
SMILESCCCNc1ccc(CN(C)c2ccccc2F)cn1
InChIInChI=1S/C16H20FN3/c1-3-10-18-16-9-8-13(11-19-16)12-20(2)15-7-5-4-6-14(15)17/h4-9,11H,3,10,12H2,1-2H3,(H,18,19)
InChIKeyVUIGRPMFDZNSGA-UHFFFAOYSA-N
MW273.35 g/mol
LogP3.68
Rot. Bonds6

About 5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine

5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine (PubChem CID 62209615) has the molecular formula C16H20FN3 and a molecular weight of 273.35 g/mol. Its IUPAC name is 5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine.

Molecular Properties

Compound Name5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine
PubChem CID62209615
Molecular FormulaC16H20FN3
Molecular Weight273.35 g/mol
Exact Mass273.16
IUPAC Name5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine
SMILESCCCNc1ccc(CN(C)c2ccccc2F)cn1
InChIInChI=1S/C16H20FN3/c1-3-10-18-16-9-8-13(11-19-16)12-20(2)15-7-5-4-6-14(15)17/h4-9,11H,3,10,12H2,1-2H3,(H,18,19)
InChIKeyVUIGRPMFDZNSGA-UHFFFAOYSA-N
XLogP3.68
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.35
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(N,2-dimethylanilino)methyl]-N-propylpyridin-2-amine
CID 62209613
5-[[methyl-[(4-methylphenyl)methyl]amino]methyl]-N-propylpyridin-2-amine
CID 62183942
5-[[methyl(propyl)amino]methyl]-N-propylpyridin-2-amine
CID 62183438
5-[[(2-chlorophenyl)methyl-methylamino]methyl]-N-propylpyridin-2-amine
CID 62207430
5-[(2-fluorophenyl)sulfanylmethyl]-N-propylpyridin-2-amine
CID 55044942
5-[(dipropylamino)methyl]-N-propylpyridin-2-amine
CID 62183383
4-[methyl-[[6-(propylamino)-3-pyridinyl]methyl]amino]benzonitrile
CID 62981948
N,N,N'-trimethyl-N'-[[6-(propylamino)-3-pyridinyl]methyl]ethane-1,2-diamine
CID 63698946
3-[methyl-[[6-(propylamino)-3-pyridinyl]methyl]amino]benzonitrile
CID 62983329
N-[[4-[2-(ethylamino)ethyl]phenyl]methyl]-2-fluoro-N-methylaniline
CID 105347406
5-[[benzyl(methyl)amino]methyl]-N-ethylpyridin-2-amine
CID 55046066
2-[ethyl-[[6-(propylamino)-3-pyridinyl]methyl]amino]ethanol
CID 62182263

Frequently Asked Questions

What is the IUPAC name of 5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine?
The IUPAC name of 5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine (CID 62209615) is 5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine.
What is the SMILES notation for 5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine?
The canonical SMILES for 5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine is CCCNc1ccc(CN(C)c2ccccc2F)cn1.
What is the InChIKey of 5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine?
The InChIKey is VUIGRPMFDZNSGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3/c1-3-10-18-16-9-8-13(11-19-16)12-20(2)15-7-5-4-6-14(15)17/h4-9,11H,3,10,12H2,1-2H3,(H,18,19).
What are the key properties of 5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine?
5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine has a molecular weight of 273.35 g/mol, XLogP of 3.68, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-fluoro-N-methylanilino)methyl]-N-propylpyridin-2-amine is sourced from PubChem (CID 62209615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).