(1-ethoxy-3-methylcyclohexyl)methanamine

C10H21NO — CID 62108909

IUPAC(1-ethoxy-3-methylcyclohexyl)methanamine
SMILESCCOC1(CN)CCCC(C)C1
InChIInChI=1S/C10H21NO/c1-3-12-10(8-11)6-4-5-9(2)7-10/h9H,3-8,11H2,1-2H3
InChIKeyORXFGKNQIWDVLJ-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.93
Rot. Bonds3

About (1-ethoxy-3-methylcyclohexyl)methanamine

(1-ethoxy-3-methylcyclohexyl)methanamine (PubChem CID 62108909) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is (1-ethoxy-3-methylcyclohexyl)methanamine.

Molecular Properties

Compound Name(1-ethoxy-3-methylcyclohexyl)methanamine
PubChem CID62108909
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name(1-ethoxy-3-methylcyclohexyl)methanamine
SMILESCCOC1(CN)CCCC(C)C1
InChIInChI=1S/C10H21NO/c1-3-12-10(8-11)6-4-5-9(2)7-10/h9H,3-8,11H2,1-2H3
InChIKeyORXFGKNQIWDVLJ-UHFFFAOYSA-N
XLogP1.93
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-ethoxy-3-methylcyclohexyl)methanamine?
The IUPAC name of (1-ethoxy-3-methylcyclohexyl)methanamine (CID 62108909) is (1-ethoxy-3-methylcyclohexyl)methanamine.
What is the SMILES notation for (1-ethoxy-3-methylcyclohexyl)methanamine?
The canonical SMILES for (1-ethoxy-3-methylcyclohexyl)methanamine is CCOC1(CN)CCCC(C)C1.
What is the InChIKey of (1-ethoxy-3-methylcyclohexyl)methanamine?
The InChIKey is ORXFGKNQIWDVLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-3-12-10(8-11)6-4-5-9(2)7-10/h9H,3-8,11H2,1-2H3.
What are the key properties of (1-ethoxy-3-methylcyclohexyl)methanamine?
(1-ethoxy-3-methylcyclohexyl)methanamine has a molecular weight of 171.28 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethoxy-3-methylcyclohexyl)methanamine is sourced from PubChem (CID 62108909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).