1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine

C15H24N2O2 — CID 81251176

IUPAC1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1cnc(C)cc1OC1CCCC(OC)C1
InChIInChI=1S/C15H24N2O2/c1-11-7-15(12(9-16-2)10-17-11)19-14-6-4-5-13(8-14)18-3/h7,10,13-14,16H,4-6,8-9H2,1-3H3
InChIKeyKZBCFSGFSCZPMP-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.45
Rot. Bonds5

About 1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine

1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine (PubChem CID 81251176) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine
PubChem CID81251176
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1cnc(C)cc1OC1CCCC(OC)C1
InChIInChI=1S/C15H24N2O2/c1-11-7-15(12(9-16-2)10-17-11)19-14-6-4-5-13(8-14)18-3/h7,10,13-14,16H,4-6,8-9H2,1-3H3
InChIKeyKZBCFSGFSCZPMP-UHFFFAOYSA-N
XLogP2.45
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine (CID 81251176) is 1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine is CNCc1cnc(C)cc1OC1CCCC(OC)C1.
What is the InChIKey of 1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine?
The InChIKey is KZBCFSGFSCZPMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11-7-15(12(9-16-2)10-17-11)19-14-6-4-5-13(8-14)18-3/h7,10,13-14,16H,4-6,8-9H2,1-3H3.
What are the key properties of 1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine?
1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine has a molecular weight of 264.37 g/mol, XLogP of 2.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(3-methoxycyclohexyl)oxy-6-methyl-3-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 81251176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).