N-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine

C14H21FN2 — CID 66273077

IUPACN-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine
SMILESCCN(c1ccc(F)cc1)C1CNCCC1C
InChIInChI=1S/C14H21FN2/c1-3-17(13-6-4-12(15)5-7-13)14-10-16-9-8-11(14)2/h4-7,11,14,16H,3,8-10H2,1-2H3
InChIKeyWORQEMBOFGQADR-UHFFFAOYSA-N
MW236.33 g/mol
LogP2.65
Rot. Bonds3

About N-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine

N-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine (PubChem CID 66273077) has the molecular formula C14H21FN2 and a molecular weight of 236.33 g/mol. Its IUPAC name is N-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine.

Molecular Properties

Compound NameN-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine
PubChem CID66273077
Molecular FormulaC14H21FN2
Molecular Weight236.33 g/mol
Exact Mass236.17
IUPAC NameN-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine
SMILESCCN(c1ccc(F)cc1)C1CNCCC1C
InChIInChI=1S/C14H21FN2/c1-3-17(13-6-4-12(15)5-7-13)14-10-16-9-8-11(14)2/h4-7,11,14,16H,3,8-10H2,1-2H3
InChIKeyWORQEMBOFGQADR-UHFFFAOYSA-N
XLogP2.65
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.33
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-N-ethyl-4-fluoroaniline
CID 57205530
trans-(1S,2S)-2-(N-ethyl-4-fluoroanilino)cyclopentan-1-ol
CID 102734657
N-(3-fluorophenyl)-N,4-dimethylpiperidin-3-amine
CID 66273075
N-(4-bromophenyl)-N-ethylpyrrolidin-3-amine
CID 70794412
N-ethyl-4-methyl-N-(2,2,2-trifluoroethyl)piperidin-3-amine
CID 66271576
N-ethyl-N-(4-ethylsulfonylphenyl)pyrrolidin-3-amine
CID 63300108
4-[ethyl(pyrrolidin-3-yl)amino]-N,N-dimethylbenzenesulfonamide
CID 63300290
N-ethyl-N-(3-fluoro-5-nitrophenyl)pyrrolidin-3-amine
CID 55205151
N-ethyl-N-phenylazepan-4-amine
CID 112690283
4-(2,4-difluorophenyl)-3-methylpiperidine
CID 66279713
N-ethyl-4-fluoro-N-pyrrolidin-3-ylbenzenesulfonamide
CID 60806159
N-[(1-ethylpyrrolidin-2-yl)methyl]-N,4-dimethylpiperidin-3-amine
CID 79313602

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine?
The IUPAC name of N-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine (CID 66273077) is N-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine.
What is the SMILES notation for N-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine?
The canonical SMILES for N-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine is CCN(c1ccc(F)cc1)C1CNCCC1C.
What is the InChIKey of N-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine?
The InChIKey is WORQEMBOFGQADR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2/c1-3-17(13-6-4-12(15)5-7-13)14-10-16-9-8-11(14)2/h4-7,11,14,16H,3,8-10H2,1-2H3.
What are the key properties of N-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine?
N-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine has a molecular weight of 236.33 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(4-fluorophenyl)-4-methylpiperidin-3-amine is sourced from PubChem (CID 66273077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).