2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine

C19H18N- — CID 23523773

IUPAC2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine
SMILES[CH-]=C=C=C=C=C=C=C=C=C=CN1CCCC1CC(C)C
InChIInChI=1S/C19H18N/c1-4-5-6-7-8-9-10-11-12-15-20-16-13-14-19(20)17-18(2)3/h1,15,18-19H,13-14,16-17H2,2-3H3/q-1
InChIKeyFSBZZPWRXOXZND-UHFFFAOYSA-N
MW260.36 g/mol
LogP3.84
Rot. Bonds3

About 2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine

2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine (PubChem CID 23523773) has the molecular formula C19H18N- and a molecular weight of 260.36 g/mol. Its IUPAC name is 2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine.

Molecular Properties

Compound Name2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine
PubChem CID23523773
Molecular FormulaC19H18N-
Molecular Weight260.36 g/mol
Exact Mass260.14
IUPAC Name2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine
SMILES[CH-]=C=C=C=C=C=C=C=C=C=CN1CCCC1CC(C)C
InChIInChI=1S/C19H18N/c1-4-5-6-7-8-9-10-11-12-15-20-16-13-14-19(20)17-18(2)3/h1,15,18-19H,13-14,16-17H2,2-3H3/q-1
InChIKeyFSBZZPWRXOXZND-UHFFFAOYSA-N
XLogP3.84
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine?
The IUPAC name of 2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine (CID 23523773) is 2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine.
What is the SMILES notation for 2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine?
The canonical SMILES for 2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine is [CH-]=C=C=C=C=C=C=C=C=C=CN1CCCC1CC(C)C.
What is the InChIKey of 2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine?
The InChIKey is FSBZZPWRXOXZND-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N/c1-4-5-6-7-8-9-10-11-12-15-20-16-13-14-19(20)17-18(2)3/h1,15,18-19H,13-14,16-17H2,2-3H3/q-1.
What are the key properties of 2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine?
2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine has a molecular weight of 260.36 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropyl)-1-undeca-1,2,3,4,5,6,7,8,9,10-decaenylpyrrolidine is sourced from PubChem (CID 23523773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).