N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine

C15H26N2O2 — CID 62462362

IUPACN-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine
SMILESCOCCN(Cc1cc(C)c(CN)o1)C(C)C1CC1
InChIInChI=1S/C15H26N2O2/c1-11-8-14(19-15(11)9-16)10-17(6-7-18-3)12(2)13-4-5-13/h8,12-13H,4-7,9-10,16H2,1-3H3
InChIKeyQBADOKMQNQPCBI-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.29
Rot. Bonds8

About N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine

N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine (PubChem CID 62462362) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine.

Molecular Properties

Compound NameN-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine
PubChem CID62462362
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine
SMILESCOCCN(Cc1cc(C)c(CN)o1)C(C)C1CC1
InChIInChI=1S/C15H26N2O2/c1-11-8-14(19-15(11)9-16)10-17(6-7-18-3)12(2)13-4-5-13/h8,12-13H,4-7,9-10,16H2,1-3H3
InChIKeyQBADOKMQNQPCBI-UHFFFAOYSA-N
XLogP2.29
TPSA51.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine?
The IUPAC name of N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine (CID 62462362) is N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine.
What is the SMILES notation for N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine?
The canonical SMILES for N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine is COCCN(Cc1cc(C)c(CN)o1)C(C)C1CC1.
What is the InChIKey of N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine?
The InChIKey is QBADOKMQNQPCBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-11-8-14(19-15(11)9-16)10-17(6-7-18-3)12(2)13-4-5-13/h8,12-13H,4-7,9-10,16H2,1-3H3.
What are the key properties of N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine?
N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine has a molecular weight of 266.38 g/mol, XLogP of 2.29, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(aminomethyl)-4-methylfuran-2-yl]methyl]-1-cyclopropyl-N-(2-methoxyethyl)ethanamine is sourced from PubChem (CID 62462362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).