N-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine

C15H23FN2 — CID 61211400

IUPACN-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine
SMILESCCC(NC1CCCN(C)C1)c1ccc(F)cc1
InChIInChI=1S/C15H23FN2/c1-3-15(12-6-8-13(16)9-7-12)17-14-5-4-10-18(2)11-14/h6-9,14-15,17H,3-5,10-11H2,1-2H3
InChIKeyWLOBCEQQVJNFSP-UHFFFAOYSA-N
MW250.36 g/mol
LogP2.96
Rot. Bonds4

About N-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine

N-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine (PubChem CID 61211400) has the molecular formula C15H23FN2 and a molecular weight of 250.36 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine
PubChem CID61211400
Molecular FormulaC15H23FN2
Molecular Weight250.36 g/mol
Exact Mass250.18
IUPAC NameN-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine
SMILESCCC(NC1CCCN(C)C1)c1ccc(F)cc1
InChIInChI=1S/C15H23FN2/c1-3-15(12-6-8-13(16)9-7-12)17-14-5-4-10-18(2)11-14/h6-9,14-15,17H,3-5,10-11H2,1-2H3
InChIKeyWLOBCEQQVJNFSP-UHFFFAOYSA-N
XLogP2.96
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethyl-N-[1-(4-fluorophenyl)propyl]piperidin-4-amine
CID 54917034
N-[1-(4-fluorophenyl)propyl]oxan-3-amine
CID 63360091
N-[1-(4-chlorophenyl)propyl]-1-ethylpiperidin-3-amine
CID 61171924
N-butan-2-yl-1-methylpiperidin-3-amine
CID 61211214
(4-fluorophenyl)-(1-methylpiperidin-3-yl)methanol
CID 142412324
1-methyl-N-[1-(4-methylsulfanylphenyl)ethyl]piperidin-3-amine
CID 61212533
1-(4-chlorophenyl)-N-[1-(1-methylpiperidin-3-yl)ethyl]propan-1-amine
CID 43688616
1-(4-fluorophenyl)-N-[(4-methylmorpholin-2-yl)methyl]propan-1-amine
CID 78997863
N-[1-(2-chloro-4-fluorophenyl)ethyl]-1-methylpiperidin-3-amine
CID 61210865
N-[1-(4-chlorophenyl)propyl]cyclopentanamine
CID 43102155
N-(cyclopropylmethyl)-1-(4-fluorophenyl)propan-1-amine
CID 43190691
N-[1-(4-fluorophenyl)propyl]-2-methylcyclopropan-1-amine
CID 62397881

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine?
The IUPAC name of N-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine (CID 61211400) is N-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine.
What is the SMILES notation for N-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine?
The canonical SMILES for N-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine is CCC(NC1CCCN(C)C1)c1ccc(F)cc1.
What is the InChIKey of N-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine?
The InChIKey is WLOBCEQQVJNFSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2/c1-3-15(12-6-8-13(16)9-7-12)17-14-5-4-10-18(2)11-14/h6-9,14-15,17H,3-5,10-11H2,1-2H3.
What are the key properties of N-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine?
N-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine has a molecular weight of 250.36 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)propyl]-1-methylpiperidin-3-amine is sourced from PubChem (CID 61211400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).