5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine

C15H23ClN2O — CID 62886168

IUPAC5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine
SMILESCCNc1ccc(Cl)c(COC2CCCC(C)C2)n1
InChIInChI=1S/C15H23ClN2O/c1-3-17-15-8-7-13(16)14(18-15)10-19-12-6-4-5-11(2)9-12/h7-8,11-12H,3-6,9-10H2,1-2H3,(H,17,18)
InChIKeyHNVOISDRLQPKQL-UHFFFAOYSA-N
MW282.81 g/mol
LogP4.26
Rot. Bonds5

About 5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine

5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine (PubChem CID 62886168) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is 5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine
PubChem CID62886168
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC Name5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine
SMILESCCNc1ccc(Cl)c(COC2CCCC(C)C2)n1
InChIInChI=1S/C15H23ClN2O/c1-3-17-15-8-7-13(16)14(18-15)10-19-12-6-4-5-11(2)9-12/h7-8,11-12H,3-6,9-10H2,1-2H3,(H,17,18)
InChIKeyHNVOISDRLQPKQL-UHFFFAOYSA-N
XLogP4.26
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine?
The IUPAC name of 5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine (CID 62886168) is 5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine.
What is the SMILES notation for 5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine?
The canonical SMILES for 5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine is CCNc1ccc(Cl)c(COC2CCCC(C)C2)n1.
What is the InChIKey of 5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine?
The InChIKey is HNVOISDRLQPKQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23ClN2O/c1-3-17-15-8-7-13(16)14(18-15)10-19-12-6-4-5-11(2)9-12/h7-8,11-12H,3-6,9-10H2,1-2H3,(H,17,18).
What are the key properties of 5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine?
5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine has a molecular weight of 282.81 g/mol, XLogP of 4.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-ethyl-6-[(3-methylcyclohexyl)oxymethyl]pyridin-2-amine is sourced from PubChem (CID 62886168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).