N-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine

C14H30N2O — CID 75382625

IUPACN-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine
SMILESCCOCC(C)NC1CCN(CC(C)C)CC1
InChIInChI=1S/C14H30N2O/c1-5-17-11-13(4)15-14-6-8-16(9-7-14)10-12(2)3/h12-15H,5-11H2,1-4H3
InChIKeyCXTBWHPXJNQJEO-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.12
Rot. Bonds7

About N-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine

N-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine (PubChem CID 75382625) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is N-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine.

Molecular Properties

Compound NameN-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine
PubChem CID75382625
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC NameN-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine
SMILESCCOCC(C)NC1CCN(CC(C)C)CC1
InChIInChI=1S/C14H30N2O/c1-5-17-11-13(4)15-14-6-8-16(9-7-14)10-12(2)3/h12-15H,5-11H2,1-4H3
InChIKeyCXTBWHPXJNQJEO-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine?
The IUPAC name of N-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine (CID 75382625) is N-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine.
What is the SMILES notation for N-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine?
The canonical SMILES for N-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine is CCOCC(C)NC1CCN(CC(C)C)CC1.
What is the InChIKey of N-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine?
The InChIKey is CXTBWHPXJNQJEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-5-17-11-13(4)15-14-6-8-16(9-7-14)10-12(2)3/h12-15H,5-11H2,1-4H3.
What are the key properties of N-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine?
N-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine has a molecular weight of 242.41 g/mol, XLogP of 2.12, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethoxypropan-2-yl)-1-(2-methylpropyl)piperidin-4-amine is sourced from PubChem (CID 75382625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).