1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine

C10H15NO — CID 104789875

IUPAC1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine
SMILESCNC(c1ccoc1C)C1CC1
InChIInChI=1S/C10H15NO/c1-7-9(5-6-12-7)10(11-2)8-3-4-8/h5-6,8,10-11H,3-4H2,1-2H3
InChIKeyYDPYAPMNINEIRB-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.26
Rot. Bonds3

About 1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine

1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine (PubChem CID 104789875) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine
PubChem CID104789875
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine
SMILESCNC(c1ccoc1C)C1CC1
InChIInChI=1S/C10H15NO/c1-7-9(5-6-12-7)10(11-2)8-3-4-8/h5-6,8,10-11H,3-4H2,1-2H3
InChIKeyYDPYAPMNINEIRB-UHFFFAOYSA-N
XLogP2.26
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine?
The IUPAC name of 1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine (CID 104789875) is 1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine.
What is the SMILES notation for 1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine?
The canonical SMILES for 1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine is CNC(c1ccoc1C)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine?
The InChIKey is YDPYAPMNINEIRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-7-9(5-6-12-7)10(11-2)8-3-4-8/h5-6,8,10-11H,3-4H2,1-2H3.
What are the key properties of 1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine?
1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine has a molecular weight of 165.24 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-methyl-1-(2-methylfuran-3-yl)methanamine is sourced from PubChem (CID 104789875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).