2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine

C11H23FN2 — CID 105454869

IUPAC2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine
SMILESCNCC(C)(F)CC1CCN(C)CC1
InChIInChI=1S/C11H23FN2/c1-11(12,9-13-2)8-10-4-6-14(3)7-5-10/h10,13H,4-9H2,1-3H3
InChIKeyBWEYHIVHAXMLNQ-UHFFFAOYSA-N
MW202.32 g/mol
LogP1.67
Rot. Bonds4

About 2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine

2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine (PubChem CID 105454869) has the molecular formula C11H23FN2 and a molecular weight of 202.32 g/mol. Its IUPAC name is 2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine.

Molecular Properties

Compound Name2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine
PubChem CID105454869
Molecular FormulaC11H23FN2
Molecular Weight202.32 g/mol
Exact Mass202.18
IUPAC Name2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine
SMILESCNCC(C)(F)CC1CCN(C)CC1
InChIInChI=1S/C11H23FN2/c1-11(12,9-13-2)8-10-4-6-14(3)7-5-10/h10,13H,4-9H2,1-3H3
InChIKeyBWEYHIVHAXMLNQ-UHFFFAOYSA-N
XLogP1.67
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.32
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-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-(2,2-difluoropropyl)-1-methylazocane
CID 154553887
2-methyl-1-(1-methylpiperidin-4-yl)propan-2-amine
CID 82598280
N,2-dimethyl-1-(1-methylazepan-4-yl)propan-2-amine
CID 84668485
2,2-difluoro-3-[(1-methylpiperidin-4-yl)methylamino]propan-1-ol
CID 106173015
N-methyl-1-(1-methylpiperidin-4-yl)methanamine;molecular hydrogen
CID 142232985
N-methyl-4-(1-methylpiperidin-4-yl)butan-1-amine
CID 83817392
(3S)-3-(2,2-dimethylpropyl)-1-methylpyrrolidine
CID 131972870
2,2-diethyl-N,N'-dimethyl-N'-[(1-methylpiperidin-4-yl)methyl]propane-1,3-diamine
CID 55175585
3-fluoro-N-methyl-3-(1-methylpyrrolidin-3-yl)butan-1-amine
CID 105443320
1-[2-methyl-1-(1-methylpiperidin-4-yl)propan-2-yl]piperazine
CID 116829848
ethane;1-methyl-4-(2,2,4-trimethylpentyl)piperidine
CID 142409504
1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
CID 62657369

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine?
The IUPAC name of 2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine (CID 105454869) is 2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine.
What is the SMILES notation for 2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine?
The canonical SMILES for 2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine is CNCC(C)(F)CC1CCN(C)CC1.
What is the InChIKey of 2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine?
The InChIKey is BWEYHIVHAXMLNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23FN2/c1-11(12,9-13-2)8-10-4-6-14(3)7-5-10/h10,13H,4-9H2,1-3H3.
What are the key properties of 2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine?
2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine has a molecular weight of 202.32 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N,2-dimethyl-3-(1-methylpiperidin-4-yl)propan-1-amine is sourced from PubChem (CID 105454869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).