1-cyclooctyl-3-cyclopropylpyrrole

C15H23N — CID 175283510

IUPAC1-cyclooctyl-3-cyclopropylpyrrole
SMILESc1cn(C2CCCCCCC2)cc1C1CC1
InChIInChI=1S/C15H23N/c1-2-4-6-15(7-5-3-1)16-11-10-14(12-16)13-8-9-13/h10-13,15H,1-9H2
InChIKeyXVUBMHPSCXDYQP-UHFFFAOYSA-N
MW217.36 g/mol
LogP4.65
Rot. Bonds2

About 1-cyclooctyl-3-cyclopropylpyrrole

1-cyclooctyl-3-cyclopropylpyrrole (PubChem CID 175283510) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 1-cyclooctyl-3-cyclopropylpyrrole.

Molecular Properties

Compound Name1-cyclooctyl-3-cyclopropylpyrrole
PubChem CID175283510
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name1-cyclooctyl-3-cyclopropylpyrrole
SMILESc1cn(C2CCCCCCC2)cc1C1CC1
InChIInChI=1S/C15H23N/c1-2-4-6-15(7-5-3-1)16-11-10-14(12-16)13-8-9-13/h10-13,15H,1-9H2
InChIKeyXVUBMHPSCXDYQP-UHFFFAOYSA-N
XLogP4.65
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cyclooctyl-3-cyclopropylpyrrole?
The IUPAC name of 1-cyclooctyl-3-cyclopropylpyrrole (CID 175283510) is 1-cyclooctyl-3-cyclopropylpyrrole.
What is the SMILES notation for 1-cyclooctyl-3-cyclopropylpyrrole?
The canonical SMILES for 1-cyclooctyl-3-cyclopropylpyrrole is c1cn(C2CCCCCCC2)cc1C1CC1.
What is the InChIKey of 1-cyclooctyl-3-cyclopropylpyrrole?
The InChIKey is XVUBMHPSCXDYQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-2-4-6-15(7-5-3-1)16-11-10-14(12-16)13-8-9-13/h10-13,15H,1-9H2.
What are the key properties of 1-cyclooctyl-3-cyclopropylpyrrole?
1-cyclooctyl-3-cyclopropylpyrrole has a molecular weight of 217.36 g/mol, XLogP of 4.65, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclooctyl-3-cyclopropylpyrrole is sourced from PubChem (CID 175283510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).