2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole

C16H24N2 — CID 15112359

IUPAC2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole
SMILESCC(C)c1cccn1CCn1cccc1C(C)C
InChIInChI=1S/C16H24N2/c1-13(2)15-7-5-9-17(15)11-12-18-10-6-8-16(18)14(3)4/h5-10,13-14H,11-12H2,1-4H3
InChIKeyVLEJSFLXXXNMSU-UHFFFAOYSA-N
MW244.38 g/mol
LogP4.24
Rot. Bonds5

About 2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole

2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole (PubChem CID 15112359) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole.

Molecular Properties

Compound Name2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole
PubChem CID15112359
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole
SMILESCC(C)c1cccn1CCn1cccc1C(C)C
InChIInChI=1S/C16H24N2/c1-13(2)15-7-5-9-17(15)11-12-18-10-6-8-16(18)14(3)4/h5-10,13-14H,11-12H2,1-4H3
InChIKeyVLEJSFLXXXNMSU-UHFFFAOYSA-N
XLogP4.24
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole?
The IUPAC name of 2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole (CID 15112359) is 2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole.
What is the SMILES notation for 2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole?
The canonical SMILES for 2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole is CC(C)c1cccn1CCn1cccc1C(C)C.
What is the InChIKey of 2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole?
The InChIKey is VLEJSFLXXXNMSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-13(2)15-7-5-9-17(15)11-12-18-10-6-8-16(18)14(3)4/h5-10,13-14H,11-12H2,1-4H3.
What are the key properties of 2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole?
2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole has a molecular weight of 244.38 g/mol, XLogP of 4.24, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-1-[2-(2-propan-2-ylpyrrol-1-yl)ethyl]pyrrole is sourced from PubChem (CID 15112359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).