N-ethyl-N-(piperidin-3-ylmethyl)propanamide

C11H22N2O — CID 106629408

IUPACN-ethyl-N-(piperidin-3-ylmethyl)propanamide
SMILESCCC(=O)N(CC)CC1CCCNC1
InChIInChI=1S/C11H22N2O/c1-3-11(14)13(4-2)9-10-6-5-7-12-8-10/h10,12H,3-9H2,1-2H3
InChIKeyWSCBETQYGYAIOI-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.24
Rot. Bonds4

About N-ethyl-N-(piperidin-3-ylmethyl)propanamide

N-ethyl-N-(piperidin-3-ylmethyl)propanamide (PubChem CID 106629408) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N-ethyl-N-(piperidin-3-ylmethyl)propanamide.

Molecular Properties

Compound NameN-ethyl-N-(piperidin-3-ylmethyl)propanamide
PubChem CID106629408
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN-ethyl-N-(piperidin-3-ylmethyl)propanamide
SMILESCCC(=O)N(CC)CC1CCCNC1
InChIInChI=1S/C11H22N2O/c1-3-11(14)13(4-2)9-10-6-5-7-12-8-10/h10,12H,3-9H2,1-2H3
InChIKeyWSCBETQYGYAIOI-UHFFFAOYSA-N
XLogP1.24
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(piperidin-3-ylmethyl)propanamide?
The IUPAC name of N-ethyl-N-(piperidin-3-ylmethyl)propanamide (CID 106629408) is N-ethyl-N-(piperidin-3-ylmethyl)propanamide.
What is the SMILES notation for N-ethyl-N-(piperidin-3-ylmethyl)propanamide?
The canonical SMILES for N-ethyl-N-(piperidin-3-ylmethyl)propanamide is CCC(=O)N(CC)CC1CCCNC1.
What is the InChIKey of N-ethyl-N-(piperidin-3-ylmethyl)propanamide?
The InChIKey is WSCBETQYGYAIOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-11(14)13(4-2)9-10-6-5-7-12-8-10/h10,12H,3-9H2,1-2H3.
What are the key properties of N-ethyl-N-(piperidin-3-ylmethyl)propanamide?
N-ethyl-N-(piperidin-3-ylmethyl)propanamide has a molecular weight of 198.31 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(piperidin-3-ylmethyl)propanamide is sourced from PubChem (CID 106629408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).