2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine

C14H23NO3 — CID 102608122

IUPAC2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine
SMILESCc1oc(COC2COC2)cc1CNC(C)(C)C
InChIInChI=1S/C14H23NO3/c1-10-11(6-15-14(2,3)4)5-12(18-10)9-17-13-7-16-8-13/h5,13,15H,6-9H2,1-4H3
InChIKeyZVSQHSPEXNCWOO-UHFFFAOYSA-N
MW253.34 g/mol
LogP2.39
Rot. Bonds5

About 2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine

2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine (PubChem CID 102608122) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is 2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine
PubChem CID102608122
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC Name2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine
SMILESCc1oc(COC2COC2)cc1CNC(C)(C)C
InChIInChI=1S/C14H23NO3/c1-10-11(6-15-14(2,3)4)5-12(18-10)9-17-13-7-16-8-13/h5,13,15H,6-9H2,1-4H3
InChIKeyZVSQHSPEXNCWOO-UHFFFAOYSA-N
XLogP2.39
TPSA43.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine 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-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine (CID 102608122) is 2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine is Cc1oc(COC2COC2)cc1CNC(C)(C)C.
What is the InChIKey of 2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine?
The InChIKey is ZVSQHSPEXNCWOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-10-11(6-15-14(2,3)4)5-12(18-10)9-17-13-7-16-8-13/h5,13,15H,6-9H2,1-4H3.
What are the key properties of 2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine?
2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine has a molecular weight of 253.34 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-methyl-5-(oxetan-3-yloxymethyl)furan-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 102608122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).