N-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine

C15H18FN3 — CID 62466616

IUPACN-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine
SMILESCCNc1ncccc1CN(C)c1cccc(F)c1
InChIInChI=1S/C15H18FN3/c1-3-17-15-12(6-5-9-18-15)11-19(2)14-8-4-7-13(16)10-14/h4-10H,3,11H2,1-2H3,(H,17,18)
InChIKeyMYCODSPJJWQGMO-UHFFFAOYSA-N
MW259.33 g/mol
LogP3.29
Rot. Bonds5

About N-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine

N-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine (PubChem CID 62466616) has the molecular formula C15H18FN3 and a molecular weight of 259.33 g/mol. Its IUPAC name is N-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine
PubChem CID62466616
Molecular FormulaC15H18FN3
Molecular Weight259.33 g/mol
Exact Mass259.15
IUPAC NameN-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine
SMILESCCNc1ncccc1CN(C)c1cccc(F)c1
InChIInChI=1S/C15H18FN3/c1-3-17-15-12(6-5-9-18-15)11-19(2)14-8-4-7-13(16)10-14/h4-10H,3,11H2,1-2H3,(H,17,18)
InChIKeyMYCODSPJJWQGMO-UHFFFAOYSA-N
XLogP3.29
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.33
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-5-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine
CID 62207366
3-(diethylaminomethyl)-N-ethylpyridin-2-amine
CID 62471645
N-ethyl-3-[[methyl(pentan-3-yl)amino]methyl]pyridin-2-amine
CID 62469722
N-ethyl-3-[[methyl(pyridin-3-ylmethyl)amino]methyl]pyridin-2-amine
CID 62470634
2-fluoro-6-[(3-fluoro-N-methylanilino)methyl]phenol
CID 112616216
N-[(4-chloro-2-pyridinyl)methyl]-3-fluoro-N-methylaniline
CID 79255179
3-fluoro-N-methyl-N-[[2-[(propan-2-ylamino)methyl]phenyl]methyl]aniline
CID 62461622
[2-(ethylamino)-3-pyridinyl]methanol
CID 62464975
3-[[cyclopentylmethyl(methyl)amino]methyl]-N-ethylpyridin-2-amine
CID 63633007
N-[[2-(ethylaminomethyl)furan-3-yl]methyl]-3-fluoro-N-methylaniline
CID 62435493
N-ethyl-3-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]pyridin-2-amine
CID 55075358
methyl 2-[(3-fluoro-N-methylanilino)methyl]benzoate
CID 82969804

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine?
The IUPAC name of N-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine (CID 62466616) is N-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine.
What is the SMILES notation for N-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine?
The canonical SMILES for N-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine is CCNc1ncccc1CN(C)c1cccc(F)c1.
What is the InChIKey of N-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine?
The InChIKey is MYCODSPJJWQGMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3/c1-3-17-15-12(6-5-9-18-15)11-19(2)14-8-4-7-13(16)10-14/h4-10H,3,11H2,1-2H3,(H,17,18).
What are the key properties of N-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine?
N-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine has a molecular weight of 259.33 g/mol, XLogP of 3.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[(3-fluoro-N-methylanilino)methyl]pyridin-2-amine is sourced from PubChem (CID 62466616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).