N-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine

C18H21FN2 — CID 103892780

IUPACN-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine
SMILESCc1cc(NC2CCN(c3ccccc3)CC2)ccc1F
InChIInChI=1S/C18H21FN2/c1-14-13-16(7-8-18(14)19)20-15-9-11-21(12-10-15)17-5-3-2-4-6-17/h2-8,13,15,20H,9-12H2,1H3
InChIKeyDFDUBGWOMARZPD-UHFFFAOYSA-N
MW284.38 g/mol
LogP4.22
Rot. Bonds3

About N-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine

N-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine (PubChem CID 103892780) has the molecular formula C18H21FN2 and a molecular weight of 284.38 g/mol. Its IUPAC name is N-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine.

Molecular Properties

Compound NameN-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine
PubChem CID103892780
Molecular FormulaC18H21FN2
Molecular Weight284.38 g/mol
Exact Mass284.17
IUPAC NameN-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine
SMILESCc1cc(NC2CCN(c3ccccc3)CC2)ccc1F
InChIInChI=1S/C18H21FN2/c1-14-13-16(7-8-18(14)19)20-15-9-11-21(12-10-15)17-5-3-2-4-6-17/h2-8,13,15,20H,9-12H2,1H3
InChIKeyDFDUBGWOMARZPD-UHFFFAOYSA-N
XLogP4.22
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-4-fluoro-3-methylaniline
CID 83694970
1-[4-(4-fluoro-3-methylanilino)piperidin-1-yl]ethanone
CID 62810559
N-(3,4-dimethoxyphenyl)-1-phenylpiperidin-4-amine
CID 155758525
3-[(1-phenylpiperidin-4-yl)amino]benzoic acid
CID 164589789
4-fluoro-N-(3-methoxycyclobutyl)-3-methylaniline
CID 104870459
N-(2,4-dichlorophenyl)-1-phenylpiperidin-4-amine
CID 106820276
2,3,5,6-tetrafluoro-N-(1-phenylpiperidin-4-yl)pyridin-4-amine
CID 133371653
4-(3,4-difluoroanilino)piperidine-1-carboxylic acid
CID 123726968
N-(3,3-dimethylcyclopentyl)-4-fluoro-3-methylaniline
CID 80705669
5-bromo-3-methyl-N-(1-phenylpiperidin-4-yl)pyridin-2-amine
CID 133360054
2-[4-[4-methyl-3-(trifluoromethyl)anilino]cyclohexyl]oxy-1-(4-phenylpiperazin-1-yl)ethanone
CID 58118367
4-[(3,5-dimethyl-4-pyridinyl)amino]-N-(4-fluoro-3-methylphenyl)piperidine-1-carboxamide
CID 134359569

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine?
The IUPAC name of N-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine (CID 103892780) is N-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine.
What is the SMILES notation for N-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine?
The canonical SMILES for N-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine is Cc1cc(NC2CCN(c3ccccc3)CC2)ccc1F.
What is the InChIKey of N-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine?
The InChIKey is DFDUBGWOMARZPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2/c1-14-13-16(7-8-18(14)19)20-15-9-11-21(12-10-15)17-5-3-2-4-6-17/h2-8,13,15,20H,9-12H2,1H3.
What are the key properties of N-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine?
N-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine has a molecular weight of 284.38 g/mol, XLogP of 4.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-methylphenyl)-1-phenylpiperidin-4-amine is sourced from PubChem (CID 103892780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).