2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine

C14H28N2 — CID 106976523

IUPAC2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine
SMILESCCCC1(CN2CCC(CC)C2)CCCN1
InChIInChI=1S/C14H28N2/c1-3-7-14(8-5-9-15-14)12-16-10-6-13(4-2)11-16/h13,15H,3-12H2,1-2H3
InChIKeySNKIJSGHCIVWJV-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.64
Rot. Bonds5

About 2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine

2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine (PubChem CID 106976523) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine.

Molecular Properties

Compound Name2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine
PubChem CID106976523
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine
SMILESCCCC1(CN2CCC(CC)C2)CCCN1
InChIInChI=1S/C14H28N2/c1-3-7-14(8-5-9-15-14)12-16-10-6-13(4-2)11-16/h13,15H,3-12H2,1-2H3
InChIKeySNKIJSGHCIVWJV-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-dimethyl-1-[(2-propylpyrrolidin-2-yl)methyl]piperidine
CID 106976543
2-[(2-propylpyrrolidin-2-yl)methyl]-1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepine
CID 106976407
2-[(2-propylpyrrolidin-2-yl)methyl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 106976479
4-[(3-ethylpyrrolidin-1-yl)methyl]-4-propylpiperidine
CID 113417902
2-(cyclopropylmethyl)-2-propylpyrrolidine
CID 66465576
2-[(2-propylpyrrolidin-2-yl)methyl]-1,3-dihydroisoindole
CID 106976381
2,2-dipropylpyrrolidine
CID 13332418
4-[(2-propylpyrrolidin-2-yl)methyl]-1,4-oxazepane
CID 106976397
5-ethyl-2-methyl-4-[(2-propylpyrrolidin-2-yl)methyl]morpholine
CID 106976297
1-ethyl-3-[(2-methylpyrrolidin-2-yl)methyl]pyrrolidine
CID 117270951
2-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-2-methylpyrrolidine
CID 64597347
N-[(2-propylpyrrolidin-2-yl)methyl]cyclopropanamine
CID 106976265

Frequently Asked Questions

What is the IUPAC name of 2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine?
The IUPAC name of 2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine (CID 106976523) is 2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine.
What is the SMILES notation for 2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine?
The canonical SMILES for 2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine is CCCC1(CN2CCC(CC)C2)CCCN1.
What is the InChIKey of 2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine?
The InChIKey is SNKIJSGHCIVWJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-3-7-14(8-5-9-15-14)12-16-10-6-13(4-2)11-16/h13,15H,3-12H2,1-2H3.
What are the key properties of 2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine?
2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine has a molecular weight of 224.39 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-ethylpyrrolidin-1-yl)methyl]-2-propylpyrrolidine is sourced from PubChem (CID 106976523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).