N-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide

C13H27N3O — CID 66272797

IUPACN-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide
SMILESCCNC(=O)CCN(C)CCC1CCNCC1
InChIInChI=1S/C13H27N3O/c1-3-15-13(17)7-11-16(2)10-6-12-4-8-14-9-5-12/h12,14H,3-11H2,1-2H3,(H,15,17)
InChIKeyKJOUYMXCDAONDO-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.83
Rot. Bonds7

About N-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide

N-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide (PubChem CID 66272797) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is N-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide.

Molecular Properties

Compound NameN-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide
PubChem CID66272797
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC NameN-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide
SMILESCCNC(=O)CCN(C)CCC1CCNCC1
InChIInChI=1S/C13H27N3O/c1-3-15-13(17)7-11-16(2)10-6-12-4-8-14-9-5-12/h12,14H,3-11H2,1-2H3,(H,15,17)
InChIKeyKJOUYMXCDAONDO-UHFFFAOYSA-N
XLogP0.83
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-methyl-2-piperidin-4-ylethanamine
CID 43263497
N-[2-(dimethylcarbamoylamino)ethyl]-3-piperidin-4-ylpropanamide
CID 83109441
1-ethyl-3-(2-piperidin-4-ylethyl)urea
CID 60903315
methyl(2-piperidin-4-ylethyl)carbamic acid
CID 69061019
2-[methyl(2-piperidin-4-ylethyl)amino]-N-(oxan-4-yl)acetamide
CID 66272158
N-(2-piperidin-4-ylethyl)-3-propoxypropanamide
CID 62714933
N-ethyl-2-(3-piperidin-4-ylpropanoylamino)propanamide
CID 55049239
N-(ethoxymethyl)-N-methyl-2-piperidin-4-ylethanamine
CID 66273653
3-[2-cyclopentylethyl(methyl)amino]propanoic acid
CID 115218342
N-butyl-2-[methyl(2-piperidin-4-ylethyl)amino]propanamide
CID 66271946
N-methyl-N-(2-piperidin-4-ylethyl)prop-2-en-1-amine
CID 67726940
2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine
CID 115210939

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide?
The IUPAC name of N-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide (CID 66272797) is N-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide.
What is the SMILES notation for N-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide?
The canonical SMILES for N-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide is CCNC(=O)CCN(C)CCC1CCNCC1.
What is the InChIKey of N-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide?
The InChIKey is KJOUYMXCDAONDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-3-15-13(17)7-11-16(2)10-6-12-4-8-14-9-5-12/h12,14H,3-11H2,1-2H3,(H,15,17).
What are the key properties of N-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide?
N-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide has a molecular weight of 241.38 g/mol, XLogP of 0.83, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-[methyl(2-piperidin-4-ylethyl)amino]propanamide is sourced from PubChem (CID 66272797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).