6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine

C14H16FN3 — CID 79243204

IUPAC6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine
SMILESCNc1cccc(CN(C)c2cccc(F)c2)n1
InChIInChI=1S/C14H16FN3/c1-16-14-8-4-6-12(17-14)10-18(2)13-7-3-5-11(15)9-13/h3-9H,10H2,1-2H3,(H,16,17)
InChIKeyWBMDPTIRANBUID-UHFFFAOYSA-N
MW245.30 g/mol
LogP2.90
Rot. Bonds4

About 6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine

6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine (PubChem CID 79243204) has the molecular formula C14H16FN3 and a molecular weight of 245.30 g/mol. Its IUPAC name is 6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine
PubChem CID79243204
Molecular FormulaC14H16FN3
Molecular Weight245.30 g/mol
Exact Mass245.13
IUPAC Name6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine
SMILESCNc1cccc(CN(C)c2cccc(F)c2)n1
InChIInChI=1S/C14H16FN3/c1-16-14-8-4-6-12(17-14)10-18(2)13-7-3-5-11(15)9-13/h3-9H,10H2,1-2H3,(H,16,17)
InChIKeyWBMDPTIRANBUID-UHFFFAOYSA-N
XLogP2.90
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[(4-methoxy-N-methylanilino)methyl]-N-methylpyridin-2-amine
CID 79243198
5-[(3-fluoro-N-methylanilino)methyl]-N-methyl-1,3,4-thiadiazol-2-amine
CID 80606202
N-[(4-chloro-2-pyridinyl)methyl]-3-fluoro-N-methylaniline
CID 79255179
6-[[(5-bromothiophen-3-yl)methyl-methylamino]methyl]-N-methylpyridin-2-amine
CID 79244017
6-[[(4-chlorophenyl)methyl-methylamino]methyl]-N-methylpyridin-2-amine
CID 79243754
N-methyl-6-[[methyl(propan-2-yl)amino]methyl]pyridin-2-amine
CID 79243333
N-(chloromethyl)-3-fluoro-N-methylaniline
CID 115262926
3-fluoro-N-methyl-N-[[5-(methylaminomethyl)furan-2-yl]methyl]aniline
CID 62435483
N-[[2-[(cyclopropylamino)methyl]-1,3-thiazol-4-yl]methyl]-3-fluoro-N-methylaniline
CID 62435139
4-N,2-diethyl-4-N-(3-fluorophenyl)-6-N-methylpyrimidine-4,6-diamine
CID 80934393
N-[(3-fluorophenyl)methyl]-N-methyl-6-(methylamino)pyridine-2-carboxamide
CID 62239255
N-ethyl-5-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine
CID 62207366

Frequently Asked Questions

What is the IUPAC name of 6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine?
The IUPAC name of 6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine (CID 79243204) is 6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine?
The canonical SMILES for 6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine is CNc1cccc(CN(C)c2cccc(F)c2)n1.
What is the InChIKey of 6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine?
The InChIKey is WBMDPTIRANBUID-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3/c1-16-14-8-4-6-12(17-14)10-18(2)13-7-3-5-11(15)9-13/h3-9H,10H2,1-2H3,(H,16,17).
What are the key properties of 6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine?
6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine has a molecular weight of 245.30 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3-fluoro-N-methylanilino)methyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 79243204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).