N-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine

C15H26N2O2 — CID 62434699

IUPACN-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine
SMILESCCCNCc1coc(CN(CCOC)C2CC2)c1
InChIInChI=1S/C15H26N2O2/c1-3-6-16-10-13-9-15(19-12-13)11-17(7-8-18-2)14-4-5-14/h9,12,14,16H,3-8,10-11H2,1-2H3
InChIKeyDSNMKKJVQLLEIW-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.39
Rot. Bonds10

About N-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine

N-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine (PubChem CID 62434699) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine
PubChem CID62434699
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine
SMILESCCCNCc1coc(CN(CCOC)C2CC2)c1
InChIInChI=1S/C15H26N2O2/c1-3-6-16-10-13-9-15(19-12-13)11-17(7-8-18-2)14-4-5-14/h9,12,14,16H,3-8,10-11H2,1-2H3
InChIKeyDSNMKKJVQLLEIW-UHFFFAOYSA-N
XLogP2.39
TPSA37.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine (CID 62434699) is N-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine is CCCNCc1coc(CN(CCOC)C2CC2)c1.
What is the InChIKey of N-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine?
The InChIKey is DSNMKKJVQLLEIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-3-6-16-10-13-9-15(19-12-13)11-17(7-8-18-2)14-4-5-14/h9,12,14,16H,3-8,10-11H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine?
N-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine has a molecular weight of 266.38 g/mol, XLogP of 2.39, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-[[4-(propylaminomethyl)furan-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62434699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).