ethane;3-methoxy-5-methylhexan-1-amine

C10H25NO — CID 178106787

IUPACethane;3-methoxy-5-methylhexan-1-amine
SMILESCC.COC(CCN)CC(C)C
InChIInChI=1S/C8H19NO.C2H6/c1-7(2)6-8(10-3)4-5-9;1-2/h7-8H,4-6,9H2,1-3H3;1-2H3
InChIKeyFLPHJHAFFOZPSK-UHFFFAOYSA-N
MW175.32 g/mol
LogP2.42
Rot. Bonds5

About ethane;3-methoxy-5-methylhexan-1-amine

ethane;3-methoxy-5-methylhexan-1-amine (PubChem CID 178106787) has the molecular formula C10H25NO and a molecular weight of 175.32 g/mol. Its IUPAC name is ethane;3-methoxy-5-methylhexan-1-amine.

Molecular Properties

Compound Nameethane;3-methoxy-5-methylhexan-1-amine
PubChem CID178106787
Molecular FormulaC10H25NO
Molecular Weight175.32 g/mol
Exact Mass175.19
IUPAC Nameethane;3-methoxy-5-methylhexan-1-amine
SMILESCC.COC(CCN)CC(C)C
InChIInChI=1S/C8H19NO.C2H6/c1-7(2)6-8(10-3)4-5-9;1-2/h7-8H,4-6,9H2,1-3H3;1-2H3
InChIKeyFLPHJHAFFOZPSK-UHFFFAOYSA-N
XLogP2.42
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.32
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze ethane;3-methoxy-5-methylhexan-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 ethane;3-methoxy-5-methylhexan-1-amine?
The IUPAC name of ethane;3-methoxy-5-methylhexan-1-amine (CID 178106787) is ethane;3-methoxy-5-methylhexan-1-amine.
What is the SMILES notation for ethane;3-methoxy-5-methylhexan-1-amine?
The canonical SMILES for ethane;3-methoxy-5-methylhexan-1-amine is CC.COC(CCN)CC(C)C.
What is the InChIKey of ethane;3-methoxy-5-methylhexan-1-amine?
The InChIKey is FLPHJHAFFOZPSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO.C2H6/c1-7(2)6-8(10-3)4-5-9;1-2/h7-8H,4-6,9H2,1-3H3;1-2H3.
What are the key properties of ethane;3-methoxy-5-methylhexan-1-amine?
ethane;3-methoxy-5-methylhexan-1-amine has a molecular weight of 175.32 g/mol, XLogP of 2.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-methoxy-5-methylhexan-1-amine is sourced from PubChem (CID 178106787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).