3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole

C10H19N — CID 178039814

IUPAC3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole
SMILESCCC1C(C)=CNC1C(C)C
InChIInChI=1S/C10H19N/c1-5-9-8(4)6-11-10(9)7(2)3/h6-7,9-11H,5H2,1-4H3
InChIKeyFJTFIHSZGYZZRT-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.54
Rot. Bonds2

About 3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole

3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole (PubChem CID 178039814) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole.

Molecular Properties

Compound Name3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole
PubChem CID178039814
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole
SMILESCCC1C(C)=CNC1C(C)C
InChIInChI=1S/C10H19N/c1-5-9-8(4)6-11-10(9)7(2)3/h6-7,9-11H,5H2,1-4H3
InChIKeyFJTFIHSZGYZZRT-UHFFFAOYSA-N
XLogP2.54
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole?
The IUPAC name of 3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole (CID 178039814) is 3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole.
What is the SMILES notation for 3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole?
The canonical SMILES for 3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole is CCC1C(C)=CNC1C(C)C.
What is the InChIKey of 3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole?
The InChIKey is FJTFIHSZGYZZRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-5-9-8(4)6-11-10(9)7(2)3/h6-7,9-11H,5H2,1-4H3.
What are the key properties of 3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole?
3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole has a molecular weight of 153.27 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-methyl-2-propan-2-yl-2,3-dihydro-1H-pyrrole is sourced from PubChem (CID 178039814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).