N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide

C20H30N2O4 — CID 108556122

IUPACN-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide
SMILESCCOc1ccc(CCC(=O)N2CCC(NC(=O)CC)CC2)cc1OC
InChIInChI=1S/C20H30N2O4/c1-4-19(23)21-16-10-12-22(13-11-16)20(24)9-7-15-6-8-17(26-5-2)18(14-15)25-3/h6,8,14,16H,4-5,7,9-13H2,1-3H3,(H,21,23)
InChIKeyTYIFTDZQVQONKJ-UHFFFAOYSA-N
MW362.47 g/mol
LogP2.54
Rot. Bonds8

About N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide

N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide (PubChem CID 108556122) has the molecular formula C20H30N2O4 and a molecular weight of 362.47 g/mol. Its IUPAC name is N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide
PubChem CID108556122
Molecular FormulaC20H30N2O4
Molecular Weight362.47 g/mol
Exact Mass362.22
IUPAC NameN-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide
SMILESCCOc1ccc(CCC(=O)N2CCC(NC(=O)CC)CC2)cc1OC
InChIInChI=1S/C20H30N2O4/c1-4-19(23)21-16-10-12-22(13-11-16)20(24)9-7-15-6-8-17(26-5-2)18(14-15)25-3/h6,8,14,16H,4-5,7,9-13H2,1-3H3,(H,21,23)
InChIKeyTYIFTDZQVQONKJ-UHFFFAOYSA-N
XLogP2.54
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]-2,2-dimethylpropanamide
CID 108558860
3-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]-1,1-dimethylurea
CID 108566557
benzyl N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]carbamate
CID 108566561
N-[1-[3-(3,4-dimethoxyphenyl)propanoyl]piperidin-4-yl]-2-phenylacetamide
CID 108551307
N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]-2-fluorobenzamide
CID 108549384
N-[1-[3-(3,4-dimethoxyphenyl)propanoyl]piperidin-4-yl]-3-methylbutanamide
CID 108549572
N-(1-benzoylpiperidin-4-yl)-3-(4-ethoxy-3-methoxyphenyl)propanamide
CID 108556529
N-cyclododecyl-3-(4-ethoxy-3-methoxyphenyl)propanamide
CID 19221706
3-(4-ethoxy-3-methoxyphenyl)-N-[1-(3-methylbenzoyl)piperidin-4-yl]propanamide
CID 108556522
N-(1-acetylpiperidin-4-yl)-3-(3,4-dimethoxyphenyl)propanamide
CID 51203874
N-[[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]methyl]-2,2,2-trifluoroacetamide
CID 108932804
3-(3,4-diethoxyphenyl)-N-(1-methylpiperidin-4-yl)propanamide
CID 99972464

Frequently Asked Questions

What is the IUPAC name of N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide?
The IUPAC name of N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide (CID 108556122) is N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide.
What is the SMILES notation for N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide?
The canonical SMILES for N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide is CCOc1ccc(CCC(=O)N2CCC(NC(=O)CC)CC2)cc1OC.
What is the InChIKey of N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide?
The InChIKey is TYIFTDZQVQONKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N2O4/c1-4-19(23)21-16-10-12-22(13-11-16)20(24)9-7-15-6-8-17(26-5-2)18(14-15)25-3/h6,8,14,16H,4-5,7,9-13H2,1-3H3,(H,21,23).
What are the key properties of N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide?
N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide has a molecular weight of 362.47 g/mol, XLogP of 2.54, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[3-(4-ethoxy-3-methoxyphenyl)propanoyl]piperidin-4-yl]propanamide is sourced from PubChem (CID 108556122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).