N-methyl-1-(5-methylfuran-2-yl)methanamine

C7H11NO — CID 2416532

IUPACN-methyl-1-(5-methylfuran-2-yl)methanamine
SMILESCNCc1ccc(C)o1
InChIInChI=1S/C7H11NO/c1-6-3-4-7(9-6)5-8-2/h3-4,8H,5H2,1-2H3
InChIKeyGHATXKUOUZLMGN-UHFFFAOYSA-N
MW125.17 g/mol
LogP1.31
Rot. Bonds2

About N-methyl-1-(5-methylfuran-2-yl)methanamine

N-methyl-1-(5-methylfuran-2-yl)methanamine (PubChem CID 2416532) has the molecular formula C7H11NO and a molecular weight of 125.17 g/mol. Its IUPAC name is N-methyl-1-(5-methylfuran-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(5-methylfuran-2-yl)methanamine
PubChem CID2416532
Molecular FormulaC7H11NO
Molecular Weight125.17 g/mol
Exact Mass125.08
IUPAC NameN-methyl-1-(5-methylfuran-2-yl)methanamine
SMILESCNCc1ccc(C)o1
InChIInChI=1S/C7H11NO/c1-6-3-4-7(9-6)5-8-2/h3-4,8H,5H2,1-2H3
InChIKeyGHATXKUOUZLMGN-UHFFFAOYSA-N
XLogP1.31
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methylfuran-2-yl)methanamine?
The IUPAC name of N-methyl-1-(5-methylfuran-2-yl)methanamine (CID 2416532) is N-methyl-1-(5-methylfuran-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(5-methylfuran-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(5-methylfuran-2-yl)methanamine is CNCc1ccc(C)o1.
What is the InChIKey of N-methyl-1-(5-methylfuran-2-yl)methanamine?
The InChIKey is GHATXKUOUZLMGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO/c1-6-3-4-7(9-6)5-8-2/h3-4,8H,5H2,1-2H3.
What are the key properties of N-methyl-1-(5-methylfuran-2-yl)methanamine?
N-methyl-1-(5-methylfuran-2-yl)methanamine has a molecular weight of 125.17 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-methylfuran-2-yl)methanamine is sourced from PubChem (CID 2416532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).