6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine

C15H24N2O — CID 63589706

IUPAC6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine
SMILESCCOc1cccc(NCC2CCC(C)CC2)n1
InChIInChI=1S/C15H24N2O/c1-3-18-15-6-4-5-14(17-15)16-11-13-9-7-12(2)8-10-13/h4-6,12-13H,3,7-11H2,1-2H3,(H,16,17)
InChIKeyGHVZNQUKMNSRSZ-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.72
Rot. Bonds5

About 6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine

6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine (PubChem CID 63589706) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine.

Molecular Properties

Compound Name6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine
PubChem CID63589706
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine
SMILESCCOc1cccc(NCC2CCC(C)CC2)n1
InChIInChI=1S/C15H24N2O/c1-3-18-15-6-4-5-14(17-15)16-11-13-9-7-12(2)8-10-13/h4-6,12-13H,3,7-11H2,1-2H3,(H,16,17)
InChIKeyGHVZNQUKMNSRSZ-UHFFFAOYSA-N
XLogP3.72
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine?
The IUPAC name of 6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine (CID 63589706) is 6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine.
What is the SMILES notation for 6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine?
The canonical SMILES for 6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine is CCOc1cccc(NCC2CCC(C)CC2)n1.
What is the InChIKey of 6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine?
The InChIKey is GHVZNQUKMNSRSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-18-15-6-4-5-14(17-15)16-11-13-9-7-12(2)8-10-13/h4-6,12-13H,3,7-11H2,1-2H3,(H,16,17).
What are the key properties of 6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine?
6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine has a molecular weight of 248.37 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-N-[(4-methylcyclohexyl)methyl]pyridin-2-amine is sourced from PubChem (CID 63589706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).