N-ethyl-3-(2-formylpiperidin-1-yl)propanamide

C11H20N2O2 — CID 62654057

IUPACN-ethyl-3-(2-formylpiperidin-1-yl)propanamide
SMILESCCNC(=O)CCN1CCCCC1C=O
InChIInChI=1S/C11H20N2O2/c1-2-12-11(15)6-8-13-7-4-3-5-10(13)9-14/h9-10H,2-8H2,1H3,(H,12,15)
InChIKeyVJLVYJYGWZAJGA-UHFFFAOYSA-N
MW212.29 g/mol
LogP0.57
Rot. Bonds5

About N-ethyl-3-(2-formylpiperidin-1-yl)propanamide

N-ethyl-3-(2-formylpiperidin-1-yl)propanamide (PubChem CID 62654057) has the molecular formula C11H20N2O2 and a molecular weight of 212.29 g/mol. Its IUPAC name is N-ethyl-3-(2-formylpiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN-ethyl-3-(2-formylpiperidin-1-yl)propanamide
PubChem CID62654057
Molecular FormulaC11H20N2O2
Molecular Weight212.29 g/mol
Exact Mass212.15
IUPAC NameN-ethyl-3-(2-formylpiperidin-1-yl)propanamide
SMILESCCNC(=O)CCN1CCCCC1C=O
InChIInChI=1S/C11H20N2O2/c1-2-12-11(15)6-8-13-7-4-3-5-10(13)9-14/h9-10H,2-8H2,1H3,(H,12,15)
InChIKeyVJLVYJYGWZAJGA-UHFFFAOYSA-N
XLogP0.57
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-2-(2-formylpiperidin-1-yl)acetamide
CID 62655143
3-[(2S)-2-ethenylpyrrolidin-1-yl]-N-ethylpropanamide
CID 156885488
3-[(2S)-2-ethenylpyrrolidin-1-yl]-N-ethylpropanamide;molecular hydrogen
CID 156885487
N-ethyl-3-[2-(1-hydroxyethyl)piperidin-1-yl]propanamide
CID 111107076
N-ethyl-3-[2-(2-oxopropyl)piperidin-1-yl]propanamide
CID 79539534
N-ethyl-3-[2-(2-hydroxypropyl)piperidin-1-yl]propanamide
CID 114338248
methyl 1-[3-(ethylamino)-3-oxopropyl]piperidine-2-carboxylate
CID 115280659
1-(3-methylbut-3-enyl)piperidine-2-carbaldehyde
CID 114476661
1-hexylpiperidine-2-carbaldehyde
CID 62655866
1-heptylpiperidine-2-carbaldehyde
CID 62655864
N-(2-chlorophenyl)-3-(2-formylpiperidin-1-yl)propanamide
CID 62654443
N-(2-fluorophenyl)-3-(2-formylpiperidin-1-yl)propanamide
CID 62654769

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(2-formylpiperidin-1-yl)propanamide?
The IUPAC name of N-ethyl-3-(2-formylpiperidin-1-yl)propanamide (CID 62654057) is N-ethyl-3-(2-formylpiperidin-1-yl)propanamide.
What is the SMILES notation for N-ethyl-3-(2-formylpiperidin-1-yl)propanamide?
The canonical SMILES for N-ethyl-3-(2-formylpiperidin-1-yl)propanamide is CCNC(=O)CCN1CCCCC1C=O.
What is the InChIKey of N-ethyl-3-(2-formylpiperidin-1-yl)propanamide?
The InChIKey is VJLVYJYGWZAJGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2/c1-2-12-11(15)6-8-13-7-4-3-5-10(13)9-14/h9-10H,2-8H2,1H3,(H,12,15).
What are the key properties of N-ethyl-3-(2-formylpiperidin-1-yl)propanamide?
N-ethyl-3-(2-formylpiperidin-1-yl)propanamide has a molecular weight of 212.29 g/mol, XLogP of 0.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(2-formylpiperidin-1-yl)propanamide is sourced from PubChem (CID 62654057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).