1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine

C18H35N3 — CID 104746187

IUPAC1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine
SMILESCCNC(CN1CCC(N2CCCCC2)C1)C1CCCC1
InChIInChI=1S/C18H35N3/c1-2-19-18(16-8-4-5-9-16)15-20-13-10-17(14-20)21-11-6-3-7-12-21/h16-19H,2-15H2,1H3
InChIKeyXSNPQTPTCBLBEL-UHFFFAOYSA-N
MW293.50 g/mol
LogP2.71
Rot. Bonds6

About 1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine

1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine (PubChem CID 104746187) has the molecular formula C18H35N3 and a molecular weight of 293.50 g/mol. Its IUPAC name is 1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine.

Molecular Properties

Compound Name1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine
PubChem CID104746187
Molecular FormulaC18H35N3
Molecular Weight293.50 g/mol
Exact Mass293.28
IUPAC Name1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine
SMILESCCNC(CN1CCC(N2CCCCC2)C1)C1CCCC1
InChIInChI=1S/C18H35N3/c1-2-19-18(16-8-4-5-9-16)15-20-13-10-17(14-20)21-11-6-3-7-12-21/h16-19H,2-15H2,1H3
InChIKeyXSNPQTPTCBLBEL-UHFFFAOYSA-N
XLogP2.71
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.50
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-1-cyclopropyl-N-ethylethanamine
CID 79932111
1-cyclopentyl-N-methyl-2-(3-pyrrolidin-1-ylpyrrolidin-1-yl)ethanamine
CID 104746172
1-cyclohexyl-2-(4-cyclopropylpiperazin-1-yl)-N-ethylethanamine
CID 104745275
2-(ethylamino)-3-(3-piperidin-1-ylpyrrolidin-1-yl)propan-1-ol
CID 64791906
1-[2-cyclohexyl-2-(ethylamino)ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 104746151
1-cyclopentyl-N-ethyl-2-(3-ethylpyrrolidin-1-yl)ethanamine
CID 104747000
1-[2-cyclohexyl-2-(ethylamino)ethyl]-N,N-diethylpyrrolidin-3-amine
CID 104746160
2-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-N-ethyl-1-(oxolan-3-yl)ethanamine
CID 104746111
1-cyclohexyl-N-ethyl-2-(4-methylazepan-1-yl)ethanamine
CID 104746295
2-(3-tert-butylpyrrolidin-1-yl)-1-cyclopentyl-N-ethylethanamine
CID 104746978
2-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)propanoic acid
CID 63165353
1-[2-cyclopentyl-2-(ethylamino)ethyl]-N,N-dimethylpiperidin-4-amine
CID 104744906

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine?
The IUPAC name of 1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine (CID 104746187) is 1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine.
What is the SMILES notation for 1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine?
The canonical SMILES for 1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine is CCNC(CN1CCC(N2CCCCC2)C1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine?
The InChIKey is XSNPQTPTCBLBEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N3/c1-2-19-18(16-8-4-5-9-16)15-20-13-10-17(14-20)21-11-6-3-7-12-21/h16-19H,2-15H2,1H3.
What are the key properties of 1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine?
1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine has a molecular weight of 293.50 g/mol, XLogP of 2.71, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-ethyl-2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine is sourced from PubChem (CID 104746187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).