2-propylpyrrol-1-amine

C7H12N2 — CID 14381083

IUPAC2-propylpyrrol-1-amine
SMILESCCCc1cccn1N
InChIInChI=1S/C7H12N2/c1-2-4-7-5-3-6-9(7)8/h3,5-6H,2,4,8H2,1H3
InChIKeyWYDCFWJOKYQAIK-UHFFFAOYSA-N
MW124.19 g/mol
LogP1.15
Rot. Bonds2

About 2-propylpyrrol-1-amine

2-propylpyrrol-1-amine (PubChem CID 14381083) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is 2-propylpyrrol-1-amine.

Molecular Properties

Compound Name2-propylpyrrol-1-amine
PubChem CID14381083
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name2-propylpyrrol-1-amine
SMILESCCCc1cccn1N
InChIInChI=1S/C7H12N2/c1-2-4-7-5-3-6-9(7)8/h3,5-6H,2,4,8H2,1H3
InChIKeyWYDCFWJOKYQAIK-UHFFFAOYSA-N
XLogP1.15
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-propylpyrrol-1-amine 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 2-propylpyrrol-1-amine?
The IUPAC name of 2-propylpyrrol-1-amine (CID 14381083) is 2-propylpyrrol-1-amine.
What is the SMILES notation for 2-propylpyrrol-1-amine?
The canonical SMILES for 2-propylpyrrol-1-amine is CCCc1cccn1N.
What is the InChIKey of 2-propylpyrrol-1-amine?
The InChIKey is WYDCFWJOKYQAIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2/c1-2-4-7-5-3-6-9(7)8/h3,5-6H,2,4,8H2,1H3.
What are the key properties of 2-propylpyrrol-1-amine?
2-propylpyrrol-1-amine has a molecular weight of 124.19 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propylpyrrol-1-amine is sourced from PubChem (CID 14381083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).