(2R,5S)-2,5-dipentylpyrrolidine

C14H29N — CID 15831903

IUPAC(2R,5S)-2,5-dipentylpyrrolidine
SMILESCCCCC[C@@H]1CC[C@H](CCCCC)N1
InChIInChI=1S/C14H29N/c1-3-5-7-9-13-11-12-14(15-13)10-8-6-4-2/h13-15H,3-12H2,1-2H3/t13-,14+
InChIKeyHVNPGJUNOHCVNX-OKILXGFUSA-N
MW211.39 g/mol
LogP4.27
Rot. Bonds8

About (2R,5S)-2,5-dipentylpyrrolidine

(2R,5S)-2,5-dipentylpyrrolidine (PubChem CID 15831903) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is (2R,5S)-2,5-dipentylpyrrolidine.

Molecular Properties

Compound Name(2R,5S)-2,5-dipentylpyrrolidine
PubChem CID15831903
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name(2R,5S)-2,5-dipentylpyrrolidine
SMILESCCCCC[C@@H]1CC[C@H](CCCCC)N1
InChIInChI=1S/C14H29N/c1-3-5-7-9-13-11-12-14(15-13)10-8-6-4-2/h13-15H,3-12H2,1-2H3/t13-,14+
InChIKeyHVNPGJUNOHCVNX-OKILXGFUSA-N
XLogP4.27
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2R,5R)-2,5-dipentylpyrrolidine;hydrochloride
CID 44889697
(2S,5R)-2-hexyl-5-nonylpyrrolidine
CID 163001890
(2R,5R)-2-pentyl-5-propylpyrrolidine
CID 10846548
(2S,5S)-2-ethyl-5-pentylpyrrolidine
CID 71392396
(2S,6R)-2-butyl-6-hexylpiperidine
CID 139750067
(2S,5R)-2-methyl-5-pentadecylpyrrolidine
CID 15722672
(2S,5S)-2-methyl-5-nonylpyrrolidine
CID 15722669
2-heptyl-5-hex-5-enylpyrrolidine
CID 592536
[(2S,5S)-5-butylpyrrolidin-2-yl]methanol
CID 131230214
(2R)-2,5-dipropylpyrrolidine
CID 143543976
(2R,5R)-2-hexyl-5-non-2-ynylpyrrolidine
CID 71662832
2-octyl-2,3,4,4a,5,6,7,7a-octahydro-1H-cyclopenta[b]pyridine
CID 106778471

Frequently Asked Questions

What is the IUPAC name of (2R,5S)-2,5-dipentylpyrrolidine?
The IUPAC name of (2R,5S)-2,5-dipentylpyrrolidine (CID 15831903) is (2R,5S)-2,5-dipentylpyrrolidine.
What is the SMILES notation for (2R,5S)-2,5-dipentylpyrrolidine?
The canonical SMILES for (2R,5S)-2,5-dipentylpyrrolidine is CCCCC[C@@H]1CC[C@H](CCCCC)N1.
What is the InChIKey of (2R,5S)-2,5-dipentylpyrrolidine?
The InChIKey is HVNPGJUNOHCVNX-OKILXGFUSA-N. The full InChI is InChI=1S/C14H29N/c1-3-5-7-9-13-11-12-14(15-13)10-8-6-4-2/h13-15H,3-12H2,1-2H3/t13-,14+.
What are the key properties of (2R,5S)-2,5-dipentylpyrrolidine?
(2R,5S)-2,5-dipentylpyrrolidine has a molecular weight of 211.39 g/mol, XLogP of 4.27, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5S)-2,5-dipentylpyrrolidine is sourced from PubChem (CID 15831903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).