2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine

C11H24N2 — CID 115432822

IUPAC2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine
SMILESCCC(CC)(CN)CNC1CC1C
InChIInChI=1S/C11H24N2/c1-4-11(5-2,7-12)8-13-10-6-9(10)3/h9-10,13H,4-8,12H2,1-3H3
InChIKeyBLORZTRZPYPUGS-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.75
Rot. Bonds6

About 2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine

2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine (PubChem CID 115432822) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine.

Molecular Properties

Compound Name2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine
PubChem CID115432822
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine
SMILESCCC(CC)(CN)CNC1CC1C
InChIInChI=1S/C11H24N2/c1-4-11(5-2,7-12)8-13-10-6-9(10)3/h9-10,13H,4-8,12H2,1-3H3
InChIKeyBLORZTRZPYPUGS-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 2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine with MolForge

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

Launch Full Analysis

Related Compounds

N'-cyclopropyl-2,2-diethylpropane-1,3-diamine
CID 115432791
2,2-diethylbutan-1-amine;hydrochloride
CID 71756050
2,2-diethylbutane-1,4-diamine
CID 56990406
2-[(3,5-dimethylpiperidin-1-yl)methyl]-2-ethylbutan-1-amine
CID 62262959
2-hydroxy-2-methyl-3-[(2-methylcyclopropyl)amino]propanoic acid
CID 104644381
2-ethyl-2-[[(2-methyloxolan-3-yl)amino]methyl]butan-1-ol
CID 82725348
N'-(2-methylcyclopropyl)heptane-1,7-diamine
CID 62409211
2-ethyl-N'-(2-methylcyclopropyl)butane-1,4-diamine
CID 81080370
N'-(tert-butylsulfamoyl)-2,2-diethylpropane-1,3-diamine
CID 106251175
N-[2-(aminomethyl)-2-ethylbutyl]propanamide
CID 106250084
N-[[4-(aminomethyl)cyclohexyl]methyl]-2-methylcyclopropan-1-amine
CID 79532868
N-(2,2-dimethylbutyl)-2,4-dimethylcyclohexan-1-amine
CID 103460870

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine?
The IUPAC name of 2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine (CID 115432822) is 2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine.
What is the SMILES notation for 2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine?
The canonical SMILES for 2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine is CCC(CC)(CN)CNC1CC1C.
What is the InChIKey of 2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine?
The InChIKey is BLORZTRZPYPUGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-4-11(5-2,7-12)8-13-10-6-9(10)3/h9-10,13H,4-8,12H2,1-3H3.
What are the key properties of 2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine?
2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-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 2,2-diethyl-N'-(2-methylcyclopropyl)propane-1,3-diamine is sourced from PubChem (CID 115432822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).