3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine

C14H23FN4 — CID 105389734

IUPAC3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine
SMILESCNCc1ccnc(N(C)C2CCCN(C)C2)c1F
InChIInChI=1S/C14H23FN4/c1-16-9-11-6-7-17-14(13(11)15)19(3)12-5-4-8-18(2)10-12/h6-7,12,16H,4-5,8-10H2,1-3H3
InChIKeyRAKOQEZRAOPPOQ-UHFFFAOYSA-N
MW266.36 g/mol
LogP1.47
Rot. Bonds4

About 3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine

3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine (PubChem CID 105389734) has the molecular formula C14H23FN4 and a molecular weight of 266.36 g/mol. Its IUPAC name is 3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine.

Molecular Properties

Compound Name3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine
PubChem CID105389734
Molecular FormulaC14H23FN4
Molecular Weight266.36 g/mol
Exact Mass266.19
IUPAC Name3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine
SMILESCNCc1ccnc(N(C)C2CCCN(C)C2)c1F
InChIInChI=1S/C14H23FN4/c1-16-9-11-6-7-17-14(13(11)15)19(3)12-5-4-8-18(2)10-12/h6-7,12,16H,4-5,8-10H2,1-3H3
InChIKeyRAKOQEZRAOPPOQ-UHFFFAOYSA-N
XLogP1.47
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.36
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-5-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyrimidin-4-amine
CID 114216274
3-fluoro-N-methyl-N-(oxan-4-yl)-4-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 105389180
3-(aminomethyl)-N-methyl-N-(1-methylpiperidin-3-yl)pyrazin-2-amine
CID 62673591
N-methyl-6-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridazin-3-amine
CID 62547013
2-N,4-N-dimethyl-4-N-(1-methylpiperidin-3-yl)pyridine-2,4-diamine
CID 113367781
4-(ethylaminomethyl)-3-fluoro-N-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridin-2-amine
CID 105389860
N-[[1-(dimethylamino)cyclobutyl]methyl]-3-fluoro-N-methyl-4-(methylaminomethyl)pyridin-2-amine
CID 105417520
N-cyclopropyl-3-fluoro-4-(methylaminomethyl)-N-(2-methylpropyl)pyridin-2-amine
CID 105389388
N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)-2-propan-2-ylpyrimidin-5-amine
CID 62547182
N-cyclohexyl-N-methyl-3-(methylaminomethyl)pyridin-2-amine
CID 62285463
4-(aminomethyl)-N-(1-ethylpiperidin-4-yl)-3-fluoro-N-methylpyridin-2-amine
CID 105389498
2-N-ethyl-4-N-methyl-4-N-(1-methylpiperidin-3-yl)pyrimidine-2,4-diamine
CID 80832495

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine?
The IUPAC name of 3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine (CID 105389734) is 3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine.
What is the SMILES notation for 3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine?
The canonical SMILES for 3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine is CNCc1ccnc(N(C)C2CCCN(C)C2)c1F.
What is the InChIKey of 3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine?
The InChIKey is RAKOQEZRAOPPOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23FN4/c1-16-9-11-6-7-17-14(13(11)15)19(3)12-5-4-8-18(2)10-12/h6-7,12,16H,4-5,8-10H2,1-3H3.
What are the key properties of 3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine?
3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine has a molecular weight of 266.36 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-methyl-4-(methylaminomethyl)-N-(1-methylpiperidin-3-yl)pyridin-2-amine is sourced from PubChem (CID 105389734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).