N-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine

C16H25FN2 — CID 115723737

IUPACN-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine
SMILESCC(Cc1cccc(F)c1)NC1CCN(C)C(C)C1
InChIInChI=1S/C16H25FN2/c1-12(9-14-5-4-6-15(17)11-14)18-16-7-8-19(3)13(2)10-16/h4-6,11-13,16,18H,7-10H2,1-3H3
InChIKeyLTWIQGBOHKDDBW-UHFFFAOYSA-N
MW264.39 g/mol
LogP2.83
Rot. Bonds4

About N-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine

N-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine (PubChem CID 115723737) has the molecular formula C16H25FN2 and a molecular weight of 264.39 g/mol. Its IUPAC name is N-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine
PubChem CID115723737
Molecular FormulaC16H25FN2
Molecular Weight264.39 g/mol
Exact Mass264.20
IUPAC NameN-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine
SMILESCC(Cc1cccc(F)c1)NC1CCN(C)C(C)C1
InChIInChI=1S/C16H25FN2/c1-12(9-14-5-4-6-15(17)11-14)18-16-7-8-19(3)13(2)10-16/h4-6,11-13,16,18H,7-10H2,1-3H3
InChIKeyLTWIQGBOHKDDBW-UHFFFAOYSA-N
XLogP2.83
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-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

N-[1-(3-fluorophenyl)propan-2-yl]cyclopropanamine
CID 115704573
N-[1-(3-fluorophenyl)ethyl]-1,2-dimethylpiperidin-4-amine
CID 81300776
N-[1-(3-fluorophenyl)propan-2-yl]-1-methylsulfonylpiperidin-4-amine
CID 115708819
3-[1-(3-fluorophenyl)propan-2-ylamino]cyclohexan-1-ol
CID 113260471
N-[1-(3-fluorophenyl)propan-2-yl]-1-oxothian-4-amine
CID 114830841
1,2-dimethyl-N-(1-thiophen-2-ylpropan-2-yl)piperidin-4-amine
CID 81302365
N-[1-(3-fluorophenyl)propan-2-yl]-3,3,5,5-tetramethylcyclohexan-1-amine
CID 114830677
3-(3-fluorophenyl)-N-(1-phenylpropan-2-yl)cyclobutan-1-amine
CID 63010559
3-[1-(3-fluorophenyl)propan-2-ylamino]-2,2-dimethylcyclobutan-1-ol
CID 115977773
N-[(1R)-1-(3-fluorophenyl)ethyl]-1,5-dimethylpyrrolidin-3-amine
CID 81467258
1,2-dimethyl-N-[1-(4-methylphenoxy)propan-2-yl]piperidin-4-amine
CID 81333951
N-[1-(3-fluorophenyl)propan-2-yl]-2,3-dihydro-1H-inden-1-amine
CID 115708061

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine?
The IUPAC name of N-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine (CID 115723737) is N-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine.
What is the SMILES notation for N-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine?
The canonical SMILES for N-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine is CC(Cc1cccc(F)c1)NC1CCN(C)C(C)C1.
What is the InChIKey of N-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine?
The InChIKey is LTWIQGBOHKDDBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2/c1-12(9-14-5-4-6-15(17)11-14)18-16-7-8-19(3)13(2)10-16/h4-6,11-13,16,18H,7-10H2,1-3H3.
What are the key properties of N-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine?
N-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine has a molecular weight of 264.39 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-fluorophenyl)propan-2-yl]-1,2-dimethylpiperidin-4-amine is sourced from PubChem (CID 115723737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).