2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine

C14H30N2O — CID 114112993

IUPAC2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine
SMILESCCC(CC)(CN)CNCC1(CCOC)CC1
InChIInChI=1S/C14H30N2O/c1-4-13(5-2,10-15)11-16-12-14(6-7-14)8-9-17-3/h16H,4-12,15H2,1-3H3
InChIKeyHZMFYTUZSDTCPE-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.16
Rot. Bonds10

About 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine

2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine (PubChem CID 114112993) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine.

Molecular Properties

Compound Name2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine
PubChem CID114112993
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine
SMILESCCC(CC)(CN)CNCC1(CCOC)CC1
InChIInChI=1S/C14H30N2O/c1-4-13(5-2,10-15)11-16-12-14(6-7-14)8-9-17-3/h16H,4-12,15H2,1-3H3
InChIKeyHZMFYTUZSDTCPE-UHFFFAOYSA-N
XLogP2.16
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]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

Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine?
The IUPAC name of 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine (CID 114112993) is 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine.
What is the SMILES notation for 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine?
The canonical SMILES for 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine is CCC(CC)(CN)CNCC1(CCOC)CC1.
What is the InChIKey of 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine?
The InChIKey is HZMFYTUZSDTCPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-4-13(5-2,10-15)11-16-12-14(6-7-14)8-9-17-3/h16H,4-12,15H2,1-3H3.
What are the key properties of 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine?
2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine has a molecular weight of 242.41 g/mol, XLogP of 2.16, 10 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-N'-[[1-(2-methoxyethyl)cyclopropyl]methyl]propane-1,3-diamine is sourced from PubChem (CID 114112993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).