methoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine

C20H43N3O — CID 177134854

IUPACmethoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine
SMILESCCC(CCNC)CN1CCN(C2CCC(C)CC2)CC1.COC
InChIInChI=1S/C18H37N3.C2H6O/c1-4-17(9-10-19-3)15-20-11-13-21(14-12-20)18-7-5-16(2)6-8-18;1-3-2/h16-19H,4-15H2,1-3H3;1-2H3
InChIKeyKQKSTRRUNHQHOG-UHFFFAOYSA-N
MW341.58 g/mol
LogP3.08
Rot. Bonds7

About methoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine

methoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine (PubChem CID 177134854) has the molecular formula C20H43N3O and a molecular weight of 341.58 g/mol. Its IUPAC name is methoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine.

Molecular Properties

Compound Namemethoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine
PubChem CID177134854
Molecular FormulaC20H43N3O
Molecular Weight341.58 g/mol
Exact Mass341.34
IUPAC Namemethoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine
SMILESCCC(CCNC)CN1CCN(C2CCC(C)CC2)CC1.COC
InChIInChI=1S/C18H37N3.C2H6O/c1-4-17(9-10-19-3)15-20-11-13-21(14-12-20)18-7-5-16(2)6-8-18;1-3-2/h16-19H,4-15H2,1-3H3;1-2H3
InChIKeyKQKSTRRUNHQHOG-UHFFFAOYSA-N
XLogP3.08
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.58
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of methoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine?
The IUPAC name of methoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine (CID 177134854) is methoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine.
What is the SMILES notation for methoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine?
The canonical SMILES for methoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine is CCC(CCNC)CN1CCN(C2CCC(C)CC2)CC1.COC.
What is the InChIKey of methoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine?
The InChIKey is KQKSTRRUNHQHOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37N3.C2H6O/c1-4-17(9-10-19-3)15-20-11-13-21(14-12-20)18-7-5-16(2)6-8-18;1-3-2/h16-19H,4-15H2,1-3H3;1-2H3.
What are the key properties of methoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine?
methoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine has a molecular weight of 341.58 g/mol, XLogP of 3.08, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethane;N-methyl-3-[[4-(4-methylcyclohexyl)piperazin-1-yl]methyl]pentan-1-amine is sourced from PubChem (CID 177134854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).