2-ethyl-4-methylidene-3-propan-2-ylpyrrole

C10H15N — CID 89263313

IUPAC2-ethyl-4-methylidene-3-propan-2-ylpyrrole
SMILESC=C1C=NC(CC)=C1C(C)C
InChIInChI=1S/C10H15N/c1-5-9-10(7(2)3)8(4)6-11-9/h6-7H,4-5H2,1-3H3
InChIKeyABWNABKUKIGUBU-UHFFFAOYSA-N
MW149.24 g/mol
LogP2.95
Rot. Bonds2

About 2-ethyl-4-methylidene-3-propan-2-ylpyrrole

2-ethyl-4-methylidene-3-propan-2-ylpyrrole (PubChem CID 89263313) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 2-ethyl-4-methylidene-3-propan-2-ylpyrrole.

Molecular Properties

Compound Name2-ethyl-4-methylidene-3-propan-2-ylpyrrole
PubChem CID89263313
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name2-ethyl-4-methylidene-3-propan-2-ylpyrrole
SMILESC=C1C=NC(CC)=C1C(C)C
InChIInChI=1S/C10H15N/c1-5-9-10(7(2)3)8(4)6-11-9/h6-7H,4-5H2,1-3H3
InChIKeyABWNABKUKIGUBU-UHFFFAOYSA-N
XLogP2.95
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.24
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-methylidene-3-propan-2-ylpyrrole?
The IUPAC name of 2-ethyl-4-methylidene-3-propan-2-ylpyrrole (CID 89263313) is 2-ethyl-4-methylidene-3-propan-2-ylpyrrole.
What is the SMILES notation for 2-ethyl-4-methylidene-3-propan-2-ylpyrrole?
The canonical SMILES for 2-ethyl-4-methylidene-3-propan-2-ylpyrrole is C=C1C=NC(CC)=C1C(C)C.
What is the InChIKey of 2-ethyl-4-methylidene-3-propan-2-ylpyrrole?
The InChIKey is ABWNABKUKIGUBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-5-9-10(7(2)3)8(4)6-11-9/h6-7H,4-5H2,1-3H3.
What are the key properties of 2-ethyl-4-methylidene-3-propan-2-ylpyrrole?
2-ethyl-4-methylidene-3-propan-2-ylpyrrole has a molecular weight of 149.24 g/mol, XLogP of 2.95, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-methylidene-3-propan-2-ylpyrrole is sourced from PubChem (CID 89263313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).