(5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole

C15H20N2 — CID 15857952

IUPAC(5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole
SMILESCC1=N/C(=C\c2[nH]c(C)c(C)c2C)C(C)=C1C
InChIInChI=1S/C15H20N2/c1-8-10(3)14(16-12(8)5)7-15-11(4)9(2)13(6)17-15/h7,16H,1-6H3/b15-7-
InChIKeyAPGBBTKLGOOHEX-CHHVJCJISA-N
MW228.34 g/mol
LogP4.09
Rot. Bonds1

About (5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole

(5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole (PubChem CID 15857952) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is (5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole.

Molecular Properties

Compound Name(5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole
PubChem CID15857952
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name(5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole
SMILESCC1=N/C(=C\c2[nH]c(C)c(C)c2C)C(C)=C1C
InChIInChI=1S/C15H20N2/c1-8-10(3)14(16-12(8)5)7-15-11(4)9(2)13(6)17-15/h7,16H,1-6H3/b15-7-
InChIKeyAPGBBTKLGOOHEX-CHHVJCJISA-N
XLogP4.09
TPSA28.15 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole?
The IUPAC name of (5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole (CID 15857952) is (5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole.
What is the SMILES notation for (5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole?
The canonical SMILES for (5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole is CC1=N/C(=C\c2[nH]c(C)c(C)c2C)C(C)=C1C.
What is the InChIKey of (5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole?
The InChIKey is APGBBTKLGOOHEX-CHHVJCJISA-N. The full InChI is InChI=1S/C15H20N2/c1-8-10(3)14(16-12(8)5)7-15-11(4)9(2)13(6)17-15/h7,16H,1-6H3/b15-7-.
What are the key properties of (5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole?
(5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole has a molecular weight of 228.34 g/mol, XLogP of 4.09, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5Z)-2,3,4-trimethyl-5-[(3,4,5-trimethyl-1H-pyrrol-2-yl)methylidene]pyrrole is sourced from PubChem (CID 15857952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).