2-methyl-3-propan-2-ylpyrrolidin-1-amine

C8H18N2 — CID 118555956

IUPAC2-methyl-3-propan-2-ylpyrrolidin-1-amine
SMILESCC(C)C1CCN(N)C1C
InChIInChI=1S/C8H18N2/c1-6(2)8-4-5-10(9)7(8)3/h6-8H,4-5,9H2,1-3H3
InChIKeyZCKNADFQCMPINI-UHFFFAOYSA-N
MW142.25 g/mol
LogP1.23
Rot. Bonds1

About 2-methyl-3-propan-2-ylpyrrolidin-1-amine

2-methyl-3-propan-2-ylpyrrolidin-1-amine (PubChem CID 118555956) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is 2-methyl-3-propan-2-ylpyrrolidin-1-amine.

Molecular Properties

Compound Name2-methyl-3-propan-2-ylpyrrolidin-1-amine
PubChem CID118555956
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name2-methyl-3-propan-2-ylpyrrolidin-1-amine
SMILESCC(C)C1CCN(N)C1C
InChIInChI=1S/C8H18N2/c1-6(2)8-4-5-10(9)7(8)3/h6-8H,4-5,9H2,1-3H3
InChIKeyZCKNADFQCMPINI-UHFFFAOYSA-N
XLogP1.23
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

Analyze 2-methyl-3-propan-2-ylpyrrolidin-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-methyl-3-propan-2-ylpyrrolidin-1-amine?
The IUPAC name of 2-methyl-3-propan-2-ylpyrrolidin-1-amine (CID 118555956) is 2-methyl-3-propan-2-ylpyrrolidin-1-amine.
What is the SMILES notation for 2-methyl-3-propan-2-ylpyrrolidin-1-amine?
The canonical SMILES for 2-methyl-3-propan-2-ylpyrrolidin-1-amine is CC(C)C1CCN(N)C1C.
What is the InChIKey of 2-methyl-3-propan-2-ylpyrrolidin-1-amine?
The InChIKey is ZCKNADFQCMPINI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-6(2)8-4-5-10(9)7(8)3/h6-8H,4-5,9H2,1-3H3.
What are the key properties of 2-methyl-3-propan-2-ylpyrrolidin-1-amine?
2-methyl-3-propan-2-ylpyrrolidin-1-amine has a molecular weight of 142.25 g/mol, XLogP of 1.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-propan-2-ylpyrrolidin-1-amine is sourced from PubChem (CID 118555956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).