1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine

C16H31N3 — CID 63167458

IUPAC1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine
SMILESCC(NCCN1CCC(N2CCCCC2)C1)C1CC1
InChIInChI=1S/C16H31N3/c1-14(15-5-6-15)17-8-12-18-11-7-16(13-18)19-9-3-2-4-10-19/h14-17H,2-13H2,1H3
InChIKeyJDDPUMPHICVDCV-UHFFFAOYSA-N
MW265.44 g/mol
LogP1.93
Rot. Bonds6

About 1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine

1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine (PubChem CID 63167458) has the molecular formula C16H31N3 and a molecular weight of 265.44 g/mol. Its IUPAC name is 1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine
PubChem CID63167458
Molecular FormulaC16H31N3
Molecular Weight265.44 g/mol
Exact Mass265.25
IUPAC Name1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine
SMILESCC(NCCN1CCC(N2CCCCC2)C1)C1CC1
InChIInChI=1S/C16H31N3/c1-14(15-5-6-15)17-8-12-18-11-7-16(13-18)19-9-3-2-4-10-19/h14-17H,2-13H2,1H3
InChIKeyJDDPUMPHICVDCV-UHFFFAOYSA-N
XLogP1.93
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.44
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 62574708
1-[1-(3-methylbutyl)pyrrolidin-3-yl]piperidine
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N-[2-(azepan-1-yl)ethyl]-1-cyclohexylethanamine
CID 61241929
2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-N-(dicyclopropylmethyl)ethanamine
CID 79917075
1-cyclopropyl-N-[2-(4-propan-2-ylpiperidin-1-yl)ethyl]ethanamine
CID 103503465
1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine
CID 54967519
5-(3-piperidin-1-ylpyrrolidin-1-yl)pentan-2-amine
CID 63169480
1-cyclopropyl-N-[2-(3,4-dimethylpiperazin-1-yl)ethyl]ethanamine
CID 63621690
1-cyclopropyl-N-[2-(3,4-dimethylpyrrolidin-1-yl)ethyl]ethanamine
CID 79183276
2-(3-piperidin-1-ylpyrrolidin-1-yl)ethanamine
CID 45157083
1-cyclopentyl-N-[2-(4-methylpiperidin-1-yl)ethyl]ethanamine
CID 62631760
1-cyclopropyl-N-[2-(2-methyl-1,4-oxazepan-4-yl)ethyl]ethanamine
CID 62967083

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine?
The IUPAC name of 1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine (CID 63167458) is 1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine.
What is the SMILES notation for 1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine?
The canonical SMILES for 1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine is CC(NCCN1CCC(N2CCCCC2)C1)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine?
The InChIKey is JDDPUMPHICVDCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3/c1-14(15-5-6-15)17-8-12-18-11-7-16(13-18)19-9-3-2-4-10-19/h14-17H,2-13H2,1H3.
What are the key properties of 1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine?
1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine has a molecular weight of 265.44 g/mol, XLogP of 1.93, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[2-(3-piperidin-1-ylpyrrolidin-1-yl)ethyl]ethanamine is sourced from PubChem (CID 63167458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).