3-cyclopropyl-4-propan-2-yl-2H-pyrrole

C10H15N — CID 170023224

IUPAC3-cyclopropyl-4-propan-2-yl-2H-pyrrole
SMILESCC(C)C1=C(C2CC2)CN=C1
InChIInChI=1S/C10H15N/c1-7(2)9-5-11-6-10(9)8-3-4-8/h5,7-8H,3-4,6H2,1-2H3
InChIKeyBIXGZQGADRJSTK-UHFFFAOYSA-N
MW149.24 g/mol
LogP2.43
Rot. Bonds2

About 3-cyclopropyl-4-propan-2-yl-2H-pyrrole

3-cyclopropyl-4-propan-2-yl-2H-pyrrole (PubChem CID 170023224) has the molecular formula C10H15N and a molecular weight of 149.24 g/mol. Its IUPAC name is 3-cyclopropyl-4-propan-2-yl-2H-pyrrole.

Molecular Properties

Compound Name3-cyclopropyl-4-propan-2-yl-2H-pyrrole
PubChem CID170023224
Molecular FormulaC10H15N
Molecular Weight149.24 g/mol
Exact Mass149.12
IUPAC Name3-cyclopropyl-4-propan-2-yl-2H-pyrrole
SMILESCC(C)C1=C(C2CC2)CN=C1
InChIInChI=1S/C10H15N/c1-7(2)9-5-11-6-10(9)8-3-4-8/h5,7-8H,3-4,6H2,1-2H3
InChIKeyBIXGZQGADRJSTK-UHFFFAOYSA-N
XLogP2.43
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 ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3-cyclopropyl-4-propan-2-yl-2H-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-cyclopropyl-4-propan-2-yl-2H-pyrrole?
The IUPAC name of 3-cyclopropyl-4-propan-2-yl-2H-pyrrole (CID 170023224) is 3-cyclopropyl-4-propan-2-yl-2H-pyrrole.
What is the SMILES notation for 3-cyclopropyl-4-propan-2-yl-2H-pyrrole?
The canonical SMILES for 3-cyclopropyl-4-propan-2-yl-2H-pyrrole is CC(C)C1=C(C2CC2)CN=C1.
What is the InChIKey of 3-cyclopropyl-4-propan-2-yl-2H-pyrrole?
The InChIKey is BIXGZQGADRJSTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N/c1-7(2)9-5-11-6-10(9)8-3-4-8/h5,7-8H,3-4,6H2,1-2H3.
What are the key properties of 3-cyclopropyl-4-propan-2-yl-2H-pyrrole?
3-cyclopropyl-4-propan-2-yl-2H-pyrrole has a molecular weight of 149.24 g/mol, XLogP of 2.43, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-4-propan-2-yl-2H-pyrrole is sourced from PubChem (CID 170023224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).