2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine

C11H24N2 — CID 62692906

IUPAC2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine
SMILESCCC(C)CNCC(C)(N)C1CC1
InChIInChI=1S/C11H24N2/c1-4-9(2)7-13-8-11(3,12)10-5-6-10/h9-10,13H,4-8,12H2,1-3H3
InChIKeyMLWBBQYXXIZSPN-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.75
Rot. Bonds6

About 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine

2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine (PubChem CID 62692906) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine.

Molecular Properties

Compound Name2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine
PubChem CID62692906
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine
SMILESCCC(C)CNCC(C)(N)C1CC1
InChIInChI=1S/C11H24N2/c1-4-9(2)7-13-8-11(3,12)10-5-6-10/h9-10,13H,4-8,12H2,1-3H3
InChIKeyMLWBBQYXXIZSPN-UHFFFAOYSA-N
XLogP1.75
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine 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-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine?
The IUPAC name of 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine (CID 62692906) is 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine.
What is the SMILES notation for 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine?
The canonical SMILES for 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine is CCC(C)CNCC(C)(N)C1CC1.
What is the InChIKey of 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine?
The InChIKey is MLWBBQYXXIZSPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-4-9(2)7-13-8-11(3,12)10-5-6-10/h9-10,13H,4-8,12H2,1-3H3.
What are the key properties of 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine?
2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine has a molecular weight of 184.33 g/mol, XLogP of 1.75, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-1-N-(2-methylbutyl)propane-1,2-diamine is sourced from PubChem (CID 62692906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).