2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine

C14H21NO2 — CID 115335826

IUPAC2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine
SMILESCC1CC1c1ccc(CNC2CCOC2C)o1
InChIInChI=1S/C14H21NO2/c1-9-7-12(9)14-4-3-11(17-14)8-15-13-5-6-16-10(13)2/h3-4,9-10,12-13,15H,5-8H2,1-2H3
InChIKeyDYULNSKQGOYDDW-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.67
Rot. Bonds4

About 2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine

2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine (PubChem CID 115335826) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is 2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine.

Molecular Properties

Compound Name2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine
PubChem CID115335826
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC Name2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine
SMILESCC1CC1c1ccc(CNC2CCOC2C)o1
InChIInChI=1S/C14H21NO2/c1-9-7-12(9)14-4-3-11(17-14)8-15-13-5-6-16-10(13)2/h3-4,9-10,12-13,15H,5-8H2,1-2H3
InChIKeyDYULNSKQGOYDDW-UHFFFAOYSA-N
XLogP2.67
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine?
The IUPAC name of 2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine (CID 115335826) is 2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine.
What is the SMILES notation for 2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine?
The canonical SMILES for 2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine is CC1CC1c1ccc(CNC2CCOC2C)o1.
What is the InChIKey of 2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine?
The InChIKey is DYULNSKQGOYDDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-9-7-12(9)14-4-3-11(17-14)8-15-13-5-6-16-10(13)2/h3-4,9-10,12-13,15H,5-8H2,1-2H3.
What are the key properties of 2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine?
2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine has a molecular weight of 235.33 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[5-(2-methylcyclopropyl)furan-2-yl]methyl]oxolan-3-amine is sourced from PubChem (CID 115335826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).