1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine

C17H34N2 — CID 55053955

IUPAC1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine
SMILESCCCCCCCC(C)N1CCCC1C1CCCN1
InChIInChI=1S/C17H34N2/c1-3-4-5-6-7-10-15(2)19-14-9-12-17(19)16-11-8-13-18-16/h15-18H,3-14H2,1-2H3
InChIKeyFBDLKWGNZGRNSP-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.95
Rot. Bonds8

About 1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine

1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine (PubChem CID 55053955) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine.

Molecular Properties

Compound Name1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine
PubChem CID55053955
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine
SMILESCCCCCCCC(C)N1CCCC1C1CCCN1
InChIInChI=1S/C17H34N2/c1-3-4-5-6-7-10-15(2)19-14-9-12-17(19)16-11-8-13-18-16/h15-18H,3-14H2,1-2H3
InChIKeyFBDLKWGNZGRNSP-UHFFFAOYSA-N
XLogP3.95
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-heptan-2-yl-2-pyrrolidin-2-ylpiperidine
CID 80557844
1-heptan-4-yl-2-pyrrolidin-2-ylpyrrolidine
CID 62274223
1-propan-2-yl-2-pyrrolidin-2-ylpiperidine
CID 63256346
3-cyclopropyl-1-heptan-2-yl-1,4-diazepane
CID 64945390
1-[1-(furan-2-yl)propan-2-yl]-2-pyrrolidin-2-ylpyrrolidine
CID 55180167
1-[1-(4-methoxyphenyl)propan-2-yl]-2-pyrrolidin-2-ylpyrrolidine
CID 63270961
ethyl 2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)butanoate
CID 64663187
3-cyclopropyl-1-octan-2-ylpiperazine
CID 64925345
1-octan-2-ylpyrrolidine-2-carboxylic acid
CID 65056476
N-(3-methylbutyl)-2-(2-pyrrolidin-2-ylpyrrolidin-1-yl)propanamide
CID 62275455
2-ethyl-1-(2-pyrrolidin-2-ylpyrrolidin-1-yl)hexan-1-one
CID 62274579
(2S)-2-(2-methyloctyl)pyrrolidine
CID 146488139

Frequently Asked Questions

What is the IUPAC name of 1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine?
The IUPAC name of 1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine (CID 55053955) is 1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine.
What is the SMILES notation for 1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine?
The canonical SMILES for 1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine is CCCCCCCC(C)N1CCCC1C1CCCN1.
What is the InChIKey of 1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine?
The InChIKey is FBDLKWGNZGRNSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-3-4-5-6-7-10-15(2)19-14-9-12-17(19)16-11-8-13-18-16/h15-18H,3-14H2,1-2H3.
What are the key properties of 1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine?
1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine has a molecular weight of 266.47 g/mol, XLogP of 3.95, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-nonan-2-yl-2-pyrrolidin-2-ylpyrrolidine is sourced from PubChem (CID 55053955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).