3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine

C11H25NO — CID 89276516

IUPAC3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine
SMILESCCCC(CNC)C(CC)COC
InChIInChI=1S/C11H25NO/c1-5-7-11(8-12-3)10(6-2)9-13-4/h10-12H,5-9H2,1-4H3
InChIKeyHFQVPWPXMABXTD-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.29
Rot. Bonds8

About 3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine

3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine (PubChem CID 89276516) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is 3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine.

Molecular Properties

Compound Name3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine
PubChem CID89276516
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Name3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine
SMILESCCCC(CNC)C(CC)COC
InChIInChI=1S/C11H25NO/c1-5-7-11(8-12-3)10(6-2)9-13-4/h10-12H,5-9H2,1-4H3
InChIKeyHFQVPWPXMABXTD-UHFFFAOYSA-N
XLogP2.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(methoxymethyl)-N-methyl-2-propylpentan-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

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine?
The IUPAC name of 3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine (CID 89276516) is 3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine.
What is the SMILES notation for 3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine?
The canonical SMILES for 3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine is CCCC(CNC)C(CC)COC.
What is the InChIKey of 3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine?
The InChIKey is HFQVPWPXMABXTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-5-7-11(8-12-3)10(6-2)9-13-4/h10-12H,5-9H2,1-4H3.
What are the key properties of 3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine?
3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine has a molecular weight of 187.33 g/mol, XLogP of 2.29, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-N-methyl-2-propylpentan-1-amine is sourced from PubChem (CID 89276516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).