1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine

C14H29NO2 — CID 103415921

IUPAC1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine
SMILESCNCC1CCCCC1CCCOCCOC
InChIInChI=1S/C14H29NO2/c1-15-12-14-7-4-3-6-13(14)8-5-9-17-11-10-16-2/h13-15H,3-12H2,1-2H3
InChIKeyMPMCKRWYHAJLEU-UHFFFAOYSA-N
MW243.39 g/mol
LogP2.46
Rot. Bonds9

About 1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine

1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine (PubChem CID 103415921) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine
PubChem CID103415921
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine
SMILESCNCC1CCCCC1CCCOCCOC
InChIInChI=1S/C14H29NO2/c1-15-12-14-7-4-3-6-13(14)8-5-9-17-11-10-16-2/h13-15H,3-12H2,1-2H3
InChIKeyMPMCKRWYHAJLEU-UHFFFAOYSA-N
XLogP2.46
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine?
The IUPAC name of 1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine (CID 103415921) is 1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine is CNCC1CCCCC1CCCOCCOC.
What is the InChIKey of 1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine?
The InChIKey is MPMCKRWYHAJLEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-15-12-14-7-4-3-6-13(14)8-5-9-17-11-10-16-2/h13-15H,3-12H2,1-2H3.
What are the key properties of 1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine?
1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine has a molecular weight of 243.39 g/mol, XLogP of 2.46, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[3-(2-methoxyethoxy)propyl]cyclohexyl]-N-methylmethanamine is sourced from PubChem (CID 103415921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).