1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine

C19H27FN2 — CID 23646086

IUPAC1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine
SMILESFC(CNC1CCN(Cc2ccccc2)CC1)=C1CCCC1
InChIInChI=1S/C19H27FN2/c20-19(17-8-4-5-9-17)14-21-18-10-12-22(13-11-18)15-16-6-2-1-3-7-16/h1-3,6-7,18,21H,4-5,8-15H2
InChIKeyBDVRACFWVCJCIV-UHFFFAOYSA-N
MW302.44 g/mol
LogP4.04
Rot. Bonds5

About 1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine

1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine (PubChem CID 23646086) has the molecular formula C19H27FN2 and a molecular weight of 302.44 g/mol. Its IUPAC name is 1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine.

Molecular Properties

Compound Name1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine
PubChem CID23646086
Molecular FormulaC19H27FN2
Molecular Weight302.44 g/mol
Exact Mass302.22
IUPAC Name1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine
SMILESFC(CNC1CCN(Cc2ccccc2)CC1)=C1CCCC1
InChIInChI=1S/C19H27FN2/c20-19(17-8-4-5-9-17)14-21-18-10-12-22(13-11-18)15-16-6-2-1-3-7-16/h1-3,6-7,18,21H,4-5,8-15H2
InChIKeyBDVRACFWVCJCIV-UHFFFAOYSA-N
XLogP4.04
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.44
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-Benzylpiperazine
CID 75994
1-(Bis(4-fluorophenyl)methyl)piperazine
CID 152932
Benzhydrylpiperazine
CID 70048
Isopropylbenzylamine
CID 66024
Norbenzphetamine
CID 102554
1-(3-Fluorobenzyl)piperazine
CID 903813
N-Benzylamphetamine
CID 10149140
Bis(alpha-methylbenzyl)amine
CID 24804
1-(4-Fluorobenzyl)piperazine
CID 796563
1-Benzyl-4-piperidylamine
CID 415852
1-Methyl-3-phenylpiperazine
CID 2760009
1-[4-(Trifluoromethyl)benzyl]piperazine
CID 2782803

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine?
The IUPAC name of 1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine (CID 23646086) is 1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine.
What is the SMILES notation for 1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine?
The canonical SMILES for 1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine is FC(CNC1CCN(Cc2ccccc2)CC1)=C1CCCC1.
What is the InChIKey of 1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine?
The InChIKey is BDVRACFWVCJCIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27FN2/c20-19(17-8-4-5-9-17)14-21-18-10-12-22(13-11-18)15-16-6-2-1-3-7-16/h1-3,6-7,18,21H,4-5,8-15H2.
What are the key properties of 1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine?
1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine has a molecular weight of 302.44 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-N-(2-cyclopentylidene-2-fluoroethyl)piperidin-4-amine is sourced from PubChem (CID 23646086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).