4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole

C14H20N2O2 — CID 10014911

IUPAC4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole
SMILESCOCCc1c[nH]c(-c2cc(CCOC)c[nH]2)c1
InChIInChI=1S/C14H20N2O2/c1-17-5-3-11-7-13(15-9-11)14-8-12(10-16-14)4-6-18-2/h7-10,15-16H,3-6H2,1-2H3
InChIKeySCBBIQMNFGRRJJ-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.39
Rot. Bonds7

About 4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole

4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole (PubChem CID 10014911) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole.

Molecular Properties

Compound Name4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole
PubChem CID10014911
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole
SMILESCOCCc1c[nH]c(-c2cc(CCOC)c[nH]2)c1
InChIInChI=1S/C14H20N2O2/c1-17-5-3-11-7-13(15-9-11)14-8-12(10-16-14)4-6-18-2/h7-10,15-16H,3-6H2,1-2H3
InChIKeySCBBIQMNFGRRJJ-UHFFFAOYSA-N
XLogP2.39
TPSA50.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole?
The IUPAC name of 4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole (CID 10014911) is 4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole.
What is the SMILES notation for 4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole?
The canonical SMILES for 4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole is COCCc1c[nH]c(-c2cc(CCOC)c[nH]2)c1.
What is the InChIKey of 4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole?
The InChIKey is SCBBIQMNFGRRJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-17-5-3-11-7-13(15-9-11)14-8-12(10-16-14)4-6-18-2/h7-10,15-16H,3-6H2,1-2H3.
What are the key properties of 4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole?
4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole has a molecular weight of 248.33 g/mol, XLogP of 2.39, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethyl)-2-[4-(2-methoxyethyl)-1H-pyrrol-2-yl]-1H-pyrrole is sourced from PubChem (CID 10014911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).