3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide

C19H30N2O2 — CID 78809618

IUPAC3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide
SMILESCCCN1CCC(NC(=O)CCc2ccccc2OCC)CC1
InChIInChI=1S/C19H30N2O2/c1-3-13-21-14-11-17(12-15-21)20-19(22)10-9-16-7-5-6-8-18(16)23-4-2/h5-8,17H,3-4,9-15H2,1-2H3,(H,20,22)
InChIKeyFHMOZXYIVLKPEI-UHFFFAOYSA-N
MW318.46 g/mol
LogP3.01
Rot. Bonds8

About 3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide

3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide (PubChem CID 78809618) has the molecular formula C19H30N2O2 and a molecular weight of 318.46 g/mol. Its IUPAC name is 3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide.

Molecular Properties

Compound Name3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide
PubChem CID78809618
Molecular FormulaC19H30N2O2
Molecular Weight318.46 g/mol
Exact Mass318.23
IUPAC Name3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide
SMILESCCCN1CCC(NC(=O)CCc2ccccc2OCC)CC1
InChIInChI=1S/C19H30N2O2/c1-3-13-21-14-11-17(12-15-21)20-19(22)10-9-16-7-5-6-8-18(16)23-4-2/h5-8,17H,3-4,9-15H2,1-2H3,(H,20,22)
InChIKeyFHMOZXYIVLKPEI-UHFFFAOYSA-N
XLogP3.01
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.46
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 4-[3-(2-ethoxyphenyl)propanoylamino]piperidine-1-carboxylate
CID 31844266
methyl 4-[3-(2-ethoxyphenyl)propanoylamino]piperidine-1-carboxylate
CID 86841468
3-(2-ethoxyphenyl)-N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]propanamide
CID 55960312
1-(2-ethoxyphenyl)-3-(1-propylpiperidin-4-yl)urea
CID 6468357
2-(2-ethoxyphenoxy)-N-(1-methylpiperidin-4-yl)acetamide
CID 86907088
N-[2-(4-benzylpiperazin-1-yl)ethyl]-3-(2-ethoxyphenyl)propanamide
CID 39302579
2-cyclopropyl-2-[3-(2-ethoxyphenyl)propanoylamino]acetic acid
CID 62696875
2-ethoxy-N-(1-propylpiperidin-4-yl)naphthalene-1-carboxamide
CID 17173537
3-(3-bromo-4-methoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide
CID 55570273
(2R)-2-(2-methylphenoxy)-N-(1-propylpiperidin-4-yl)propanamide
CID 27233966
3-(2-ethoxyphenyl)-N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)propanamide
CID 110903509
4-(4-methoxyphenoxy)-N-(1-propylpiperidin-4-yl)butanamide
CID 86907108

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide?
The IUPAC name of 3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide (CID 78809618) is 3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide.
What is the SMILES notation for 3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide?
The canonical SMILES for 3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide is CCCN1CCC(NC(=O)CCc2ccccc2OCC)CC1.
What is the InChIKey of 3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide?
The InChIKey is FHMOZXYIVLKPEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O2/c1-3-13-21-14-11-17(12-15-21)20-19(22)10-9-16-7-5-6-8-18(16)23-4-2/h5-8,17H,3-4,9-15H2,1-2H3,(H,20,22).
What are the key properties of 3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide?
3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide has a molecular weight of 318.46 g/mol, XLogP of 3.01, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxyphenyl)-N-(1-propylpiperidin-4-yl)propanamide is sourced from PubChem (CID 78809618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).