1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine

C15H21FN2O — CID 115313152

IUPAC1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine
SMILESCC1CC(N)CCN1CC1Cc2cc(F)ccc2O1
InChIInChI=1S/C15H21FN2O/c1-10-6-13(17)4-5-18(10)9-14-8-11-7-12(16)2-3-15(11)19-14/h2-3,7,10,13-14H,4-6,8-9,17H2,1H3
InChIKeyRIGPCARJURHTBI-UHFFFAOYSA-N
MW264.34 g/mol
LogP1.94
Rot. Bonds2

About 1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine

1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine (PubChem CID 115313152) has the molecular formula C15H21FN2O and a molecular weight of 264.34 g/mol. Its IUPAC name is 1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine.

Molecular Properties

Compound Name1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine
PubChem CID115313152
Molecular FormulaC15H21FN2O
Molecular Weight264.34 g/mol
Exact Mass264.16
IUPAC Name1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine
SMILESCC1CC(N)CCN1CC1Cc2cc(F)ccc2O1
InChIInChI=1S/C15H21FN2O/c1-10-6-13(17)4-5-18(10)9-14-8-11-7-12(16)2-3-15(11)19-14/h2-3,7,10,13-14H,4-6,8-9,17H2,1H3
InChIKeyRIGPCARJURHTBI-UHFFFAOYSA-N
XLogP1.94
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-5-methylmorpholin-2-yl]methanamine
CID 81216887
[1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]piperidin-2-yl]methanamine
CID 66364320
1-[1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]piperidin-4-yl]ethanamine
CID 66366018
1-[1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]pyrrolidin-2-yl]-N-methylmethanamine
CID 66364910
3-ethyl-1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]piperidin-4-amine
CID 81459003
4-N-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-4-N-methylcyclohexane-1,4-diamine
CID 79121920
[(2R)-5-fluoro-2,3-dihydro-1-benzofuran-2-yl]methanamine
CID 92670115
3-chloro-1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]pyrrolidine
CID 66362056
N-[[1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]pyrrolidin-2-yl]methyl]propan-1-amine
CID 66365688
1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]piperidine-4-carbonitrile
CID 66363731
3-ethyl-1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]azetidin-3-amine
CID 66362444
1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2,3-dihydroindol-6-amine
CID 66363550

Frequently Asked Questions

What is the IUPAC name of 1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine?
The IUPAC name of 1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine (CID 115313152) is 1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine.
What is the SMILES notation for 1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine?
The canonical SMILES for 1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine is CC1CC(N)CCN1CC1Cc2cc(F)ccc2O1.
What is the InChIKey of 1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine?
The InChIKey is RIGPCARJURHTBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O/c1-10-6-13(17)4-5-18(10)9-14-8-11-7-12(16)2-3-15(11)19-14/h2-3,7,10,13-14H,4-6,8-9,17H2,1H3.
What are the key properties of 1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine?
1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine has a molecular weight of 264.34 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methyl]-2-methylpiperidin-4-amine is sourced from PubChem (CID 115313152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).