N-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride

C19H30ClFN2 — CID 119932442

IUPACN-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride
SMILESCl.Fc1ccc(CCN(CC2CCCNC2)C2CCCC2)cc1
InChIInChI=1S/C19H29FN2.ClH/c20-18-9-7-16(8-10-18)11-13-22(19-5-1-2-6-19)15-17-4-3-12-21-14-17;/h7-10,17,19,21H,1-6,11-15H2;1H
InChIKeyADRSNWOQRCGWKT-UHFFFAOYSA-N
MW340.91 g/mol
LogP4.03
Rot. Bonds6

About N-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride

N-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride (PubChem CID 119932442) has the molecular formula C19H30ClFN2 and a molecular weight of 340.91 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride
PubChem CID119932442
Molecular FormulaC19H30ClFN2
Molecular Weight340.91 g/mol
Exact Mass340.21
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride
SMILESCl.Fc1ccc(CCN(CC2CCCNC2)C2CCCC2)cc1
InChIInChI=1S/C19H29FN2.ClH/c20-18-9-7-16(8-10-18)11-13-22(19-5-1-2-6-19)15-17-4-3-12-21-14-17;/h7-10,17,19,21H,1-6,11-15H2;1H
InChIKeyADRSNWOQRCGWKT-UHFFFAOYSA-N
XLogP4.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.91
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[2-(4-fluorophenyl)ethyl]piperidine;hydrochloride
CID 126844820
N-[2-(4-fluorophenyl)ethyl]-N-methyl-2-piperidin-3-ylethanamine
CID 115211456
N-[(4-chlorophenyl)methyl]-N-(piperidin-3-ylmethyl)cyclopropanamine;hydrochloride
CID 119930119
2-[[cyclopropyl(piperidin-3-ylmethyl)amino]methyl]-4-fluorophenol
CID 107699302
N-[(4-fluorophenyl)methyl]-N-(piperidin-3-ylmethyl)ethanamine
CID 106624468
N-[[4-(difluoromethyl)phenyl]methyl]-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106624895
N-(cycloheptylmethyl)-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106625038
3-[2-(4-fluorophenyl)ethoxymethyl]piperidine
CID 45074936
N-benzyl-N-[[(3R)-piperidin-3-yl]methyl]cyclopropanamine
CID 96555707
N-[(4-fluorophenyl)methyl]-N-methyl-1-pyrrolidin-3-ylmethanamine
CID 19358411
2-[ethyl(piperidin-3-ylmethyl)amino]-N-[(4-fluorophenyl)methyl]acetamide;hydrochloride
CID 119929420
N-(2-methylsulfanylethyl)-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106639574

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride (CID 119932442) is N-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride is Cl.Fc1ccc(CCN(CC2CCCNC2)C2CCCC2)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride?
The InChIKey is ADRSNWOQRCGWKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29FN2.ClH/c20-18-9-7-16(8-10-18)11-13-22(19-5-1-2-6-19)15-17-4-3-12-21-14-17;/h7-10,17,19,21H,1-6,11-15H2;1H.
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride?
N-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride has a molecular weight of 340.91 g/mol, XLogP of 4.03, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-N-(piperidin-3-ylmethyl)cyclopentanamine;hydrochloride is sourced from PubChem (CID 119932442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).