2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine

C19H23FN2 — CID 126696260

IUPAC2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine
SMILESNC1CCN(Cc2ccc(F)cc2)C(Cc2ccccc2)C1
InChIInChI=1S/C19H23FN2/c20-17-8-6-16(7-9-17)14-22-11-10-18(21)13-19(22)12-15-4-2-1-3-5-15/h1-9,18-19H,10-14,21H2
InChIKeyHPMFAMPAHLBSEM-UHFFFAOYSA-N
MW298.41 g/mol
LogP3.36
Rot. Bonds4

About 2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine

2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine (PubChem CID 126696260) has the molecular formula C19H23FN2 and a molecular weight of 298.41 g/mol. Its IUPAC name is 2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine.

Molecular Properties

Compound Name2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine
PubChem CID126696260
Molecular FormulaC19H23FN2
Molecular Weight298.41 g/mol
Exact Mass298.18
IUPAC Name2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine
SMILESNC1CCN(Cc2ccc(F)cc2)C(Cc2ccccc2)C1
InChIInChI=1S/C19H23FN2/c20-17-8-6-16(7-9-17)14-22-11-10-18(21)13-19(22)12-15-4-2-1-3-5-15/h1-9,18-19H,10-14,21H2
InChIKeyHPMFAMPAHLBSEM-UHFFFAOYSA-N
XLogP3.36
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-benzyl-1-cyclopropylpiperidin-4-amine
CID 68576010
1-[4-amino-2-[(4-fluorophenyl)methyl]piperidin-1-yl]-2,2,2-trifluoroethanone
CID 154365639
[(2R)-1-[(4-fluorophenyl)methyl]pyrrolidin-2-yl]methanamine
CID 14709038
2-[4-benzyl-2-[(3,4-dichlorophenyl)methyl]piperidin-1-yl]ethanamine
CID 142193593
2-(1,2-dibenzylpiperidin-4-yl)-3,4-dihydro-1H-isoquinoline
CID 175501827
1-[(4-fluorophenyl)methyl]pyrrolidin-3-amine;dihydrochloride
CID 53422149
hypochlorous acid;1-(2-phenylethyl)piperidin-4-amine
CID 159010718
[1-[(4-fluorophenyl)methyl]piperidin-2-yl]methanamine;hydrochloride
CID 119916113
(2R)-2-[(4-fluorophenyl)methyl]-1-phenylpyrrolidine
CID 134966567
1-benzyl-3-[(4-fluorophenyl)methyl]piperazine
CID 18703475
3-[(4-fluorophenyl)methyl]cyclohexan-1-amine
CID 64504117
(1R)-2-[(2S)-1-benzylpiperidin-2-yl]-1-(4-fluorophenyl)ethanol
CID 125487473

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine?
The IUPAC name of 2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine (CID 126696260) is 2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine.
What is the SMILES notation for 2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine?
The canonical SMILES for 2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine is NC1CCN(Cc2ccc(F)cc2)C(Cc2ccccc2)C1.
What is the InChIKey of 2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine?
The InChIKey is HPMFAMPAHLBSEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2/c20-17-8-6-16(7-9-17)14-22-11-10-18(21)13-19(22)12-15-4-2-1-3-5-15/h1-9,18-19H,10-14,21H2.
What are the key properties of 2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine?
2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine has a molecular weight of 298.41 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine is sourced from PubChem (CID 126696260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).