N-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide

C17H26N2O2 — CID 17250230

IUPACN-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide
SMILESCCN1CCC(NC(=O)CCc2ccc(OC)cc2)CC1
InChIInChI=1S/C17H26N2O2/c1-3-19-12-10-15(11-13-19)18-17(20)9-6-14-4-7-16(21-2)8-5-14/h4-5,7-8,15H,3,6,9-13H2,1-2H3,(H,18,20)
InChIKeyGNEWTKALAMCGLQ-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.23
Rot. Bonds6

About N-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide

N-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide (PubChem CID 17250230) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide
PubChem CID17250230
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide
SMILESCCN1CCC(NC(=O)CCc2ccc(OC)cc2)CC1
InChIInChI=1S/C17H26N2O2/c1-3-19-12-10-15(11-13-19)18-17(20)9-6-14-4-7-16(21-2)8-5-14/h4-5,7-8,15H,3,6,9-13H2,1-2H3,(H,18,20)
InChIKeyGNEWTKALAMCGLQ-UHFFFAOYSA-N
XLogP2.23
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide?
The IUPAC name of N-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide (CID 17250230) is N-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide.
What is the SMILES notation for N-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide?
The canonical SMILES for N-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide is CCN1CCC(NC(=O)CCc2ccc(OC)cc2)CC1.
What is the InChIKey of N-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide?
The InChIKey is GNEWTKALAMCGLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-3-19-12-10-15(11-13-19)18-17(20)9-6-14-4-7-16(21-2)8-5-14/h4-5,7-8,15H,3,6,9-13H2,1-2H3,(H,18,20).
What are the key properties of N-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide?
N-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide has a molecular weight of 290.41 g/mol, XLogP of 2.23, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpiperidin-4-yl)-3-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 17250230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).