2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine

C17H36N2O — CID 134335534

IUPAC2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine
SMILESCC(C)(C)NCCC1CCN(CCOC(C)(C)C)CC1
InChIInChI=1S/C17H36N2O/c1-16(2,3)18-10-7-15-8-11-19(12-9-15)13-14-20-17(4,5)6/h15,18H,7-14H2,1-6H3
InChIKeyNMGWBSQZJRFCCD-UHFFFAOYSA-N
MW284.49 g/mol
LogP3.29
Rot. Bonds6

About 2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine

2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine (PubChem CID 134335534) has the molecular formula C17H36N2O and a molecular weight of 284.49 g/mol. Its IUPAC name is 2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine
PubChem CID134335534
Molecular FormulaC17H36N2O
Molecular Weight284.49 g/mol
Exact Mass284.28
IUPAC Name2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine
SMILESCC(C)(C)NCCC1CCN(CCOC(C)(C)C)CC1
InChIInChI=1S/C17H36N2O/c1-16(2,3)18-10-7-15-8-11-19(12-9-15)13-14-20-17(4,5)6/h15,18H,7-14H2,1-6H3
InChIKeyNMGWBSQZJRFCCD-UHFFFAOYSA-N
XLogP3.29
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.49
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine (CID 134335534) is 2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine is CC(C)(C)NCCC1CCN(CCOC(C)(C)C)CC1.
What is the InChIKey of 2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine?
The InChIKey is NMGWBSQZJRFCCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2O/c1-16(2,3)18-10-7-15-8-11-19(12-9-15)13-14-20-17(4,5)6/h15,18H,7-14H2,1-6H3.
What are the key properties of 2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine?
2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine has a molecular weight of 284.49 g/mol, XLogP of 3.29, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]ethyl]propan-2-amine is sourced from PubChem (CID 134335534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).