2-methoxy-3-methylcyclopropen-1-amine

C5H9NO — CID 163794592

IUPAC2-methoxy-3-methylcyclopropen-1-amine
SMILESCOC1=C(N)C1C
InChIInChI=1S/C5H9NO/c1-3-4(6)5(3)7-2/h3H,6H2,1-2H3
InChIKeyMZRPEGRBLYBOHV-UHFFFAOYSA-N
MW99.13 g/mol
LogP0.45
Rot. Bonds1

About 2-methoxy-3-methylcyclopropen-1-amine

2-methoxy-3-methylcyclopropen-1-amine (PubChem CID 163794592) has the molecular formula C5H9NO and a molecular weight of 99.13 g/mol. Its IUPAC name is 2-methoxy-3-methylcyclopropen-1-amine.

Molecular Properties

Compound Name2-methoxy-3-methylcyclopropen-1-amine
PubChem CID163794592
Molecular FormulaC5H9NO
Molecular Weight99.13 g/mol
Exact Mass99.07
IUPAC Name2-methoxy-3-methylcyclopropen-1-amine
SMILESCOC1=C(N)C1C
InChIInChI=1S/C5H9NO/c1-3-4(6)5(3)7-2/h3H,6H2,1-2H3
InChIKeyMZRPEGRBLYBOHV-UHFFFAOYSA-N
XLogP0.45
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.13
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methoxy-3-methylcyclopropen-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-1-methoxy-3-methylbut-1-ene-1,2-diamine
CID 139354665
(2-Amino-1-methoxy-3-methylbut-1-enyl)azanium
CID 146703350
1-Methoxy-3-methylbut-1-ene-1,2-diamine
CID 146703351

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-3-methylcyclopropen-1-amine?
The IUPAC name of 2-methoxy-3-methylcyclopropen-1-amine (CID 163794592) is 2-methoxy-3-methylcyclopropen-1-amine.
What is the SMILES notation for 2-methoxy-3-methylcyclopropen-1-amine?
The canonical SMILES for 2-methoxy-3-methylcyclopropen-1-amine is COC1=C(N)C1C.
What is the InChIKey of 2-methoxy-3-methylcyclopropen-1-amine?
The InChIKey is MZRPEGRBLYBOHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO/c1-3-4(6)5(3)7-2/h3H,6H2,1-2H3.
What are the key properties of 2-methoxy-3-methylcyclopropen-1-amine?
2-methoxy-3-methylcyclopropen-1-amine has a molecular weight of 99.13 g/mol, XLogP of 0.45, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-3-methylcyclopropen-1-amine is sourced from PubChem (CID 163794592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).