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

C16H25FN2 — CID 114794766

IUPAC1-[1-(4-fluorophenyl)propan-2-yl]-N,4-dimethylpiperidin-4-amine
SMILESCNC1(C)CCN(C(C)Cc2ccc(F)cc2)CC1
InChIInChI=1S/C16H25FN2/c1-13(12-14-4-6-15(17)7-5-14)19-10-8-16(2,18-3)9-11-19/h4-7,13,18H,8-12H2,1-3H3
InChIKeyZNXGRALLGOZMRY-UHFFFAOYSA-N
MW264.39 g/mol
LogP2.83
Rot. Bonds4

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

1-[1-(4-fluorophenyl)propan-2-yl]-N,4-dimethylpiperidin-4-amine (PubChem CID 114794766) has the molecular formula C16H25FN2 and a molecular weight of 264.39 g/mol. Its IUPAC name is 1-[1-(4-fluorophenyl)propan-2-yl]-N,4-dimethylpiperidin-4-amine.

Molecular Properties

Compound Name1-[1-(4-fluorophenyl)propan-2-yl]-N,4-dimethylpiperidin-4-amine
PubChem CID114794766
Molecular FormulaC16H25FN2
Molecular Weight264.39 g/mol
Exact Mass264.20
IUPAC Name1-[1-(4-fluorophenyl)propan-2-yl]-N,4-dimethylpiperidin-4-amine
SMILESCNC1(C)CCN(C(C)Cc2ccc(F)cc2)CC1
InChIInChI=1S/C16H25FN2/c1-13(12-14-4-6-15(17)7-5-14)19-10-8-16(2,18-3)9-11-19/h4-7,13,18H,8-12H2,1-3H3
InChIKeyZNXGRALLGOZMRY-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

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Related Compounds

1-[1-(4-fluorophenyl)propan-2-yl]-1,5-diazocane
CID 62992839
1-[(4-fluorophenyl)methylsulfonyl]-N,4-dimethylpiperidin-4-amine
CID 115304816
1-[1-(4-fluorophenyl)propan-2-yl]piperidine-4-carboxylic acid
CID 84751496
1-[(2S)-1-(4-fluorophenyl)propan-2-yl]piperidine-4-carboxamide
CID 40514699
1-[(2S)-1-(4-fluorophenyl)propan-2-yl]-4-(2-methoxyphenyl)piperazine
CID 40514838
1-[1-(4-fluorophenyl)propan-2-yl]-2,2-dimethylpiperazine
CID 114794773
1-[1-(4-fluorophenyl)propan-2-yl]-3-propan-2-ylpiperazine
CID 64954587
N,4-dimethyl-1-[1-(4-methylsulfanylphenyl)ethyl]piperidin-4-amine
CID 115304077
1-(4-fluorophenyl)-N-[1-(1-methylcyclopropyl)ethyl]propan-2-amine
CID 62995406
1-[1-(3-fluorophenyl)propan-2-yl]-4-methylpiperidine-4-carboxylic acid
CID 114834742
1-[1-(4-fluorophenyl)propan-2-yl]-1,4-diazaspiro[5.5]undecane
CID 114832357
3-[(2S)-1-phenylpropan-2-yl]-3-azaspiro[5.5]undecane
CID 125489630

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-fluorophenyl)propan-2-yl]-N,4-dimethylpiperidin-4-amine?
The IUPAC name of 1-[1-(4-fluorophenyl)propan-2-yl]-N,4-dimethylpiperidin-4-amine (CID 114794766) is 1-[1-(4-fluorophenyl)propan-2-yl]-N,4-dimethylpiperidin-4-amine.
What is the SMILES notation for 1-[1-(4-fluorophenyl)propan-2-yl]-N,4-dimethylpiperidin-4-amine?
The canonical SMILES for 1-[1-(4-fluorophenyl)propan-2-yl]-N,4-dimethylpiperidin-4-amine is CNC1(C)CCN(C(C)Cc2ccc(F)cc2)CC1.
What is the InChIKey of 1-[1-(4-fluorophenyl)propan-2-yl]-N,4-dimethylpiperidin-4-amine?
The InChIKey is ZNXGRALLGOZMRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2/c1-13(12-14-4-6-15(17)7-5-14)19-10-8-16(2,18-3)9-11-19/h4-7,13,18H,8-12H2,1-3H3.
What are the key properties of 1-[1-(4-fluorophenyl)propan-2-yl]-N,4-dimethylpiperidin-4-amine?
1-[1-(4-fluorophenyl)propan-2-yl]-N,4-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 1-[1-(4-fluorophenyl)propan-2-yl]-N,4-dimethylpiperidin-4-amine is sourced from PubChem (CID 114794766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).