N-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide

C23H29N3O3 — CID 54831051

IUPACN-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide
SMILESCCOc1ccc(NC(=O)CNc2ccc(C(=O)N3CCC(C)CC3)cc2)cc1
InChIInChI=1S/C23H29N3O3/c1-3-29-21-10-8-20(9-11-21)25-22(27)16-24-19-6-4-18(5-7-19)23(28)26-14-12-17(2)13-15-26/h4-11,17,24H,3,12-16H2,1-2H3,(H,25,27)
InChIKeyTTWOEAZYYIWXKU-UHFFFAOYSA-N
MW395.50 g/mol
LogP4.01
Rot. Bonds7

About N-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide

N-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide (PubChem CID 54831051) has the molecular formula C23H29N3O3 and a molecular weight of 395.50 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide
PubChem CID54831051
Molecular FormulaC23H29N3O3
Molecular Weight395.50 g/mol
Exact Mass395.22
IUPAC NameN-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide
SMILESCCOc1ccc(NC(=O)CNc2ccc(C(=O)N3CCC(C)CC3)cc2)cc1
InChIInChI=1S/C23H29N3O3/c1-3-29-21-10-8-20(9-11-21)25-22(27)16-24-19-6-4-18(5-7-19)23(28)26-14-12-17(2)13-15-26/h4-11,17,24H,3,12-16H2,1-2H3,(H,25,27)
InChIKeyTTWOEAZYYIWXKU-UHFFFAOYSA-N
XLogP4.01
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.50
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-heptoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide
CID 54830572
N-(4-ethoxyphenyl)-2-[3-(4-methylpiperidine-1-carbonyl)anilino]acetamide
CID 54843517
2-(3-ethoxyanilino)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
CID 54826455
2-(4-bromoanilino)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
CID 54811108
2-(4-methylphenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
CID 17179607
N-ethyl-4-[[2-[4-(4-methylpiperidine-1-carbonyl)anilino]-2-oxoethyl]amino]benzamide
CID 54839291
3-methyl-N-[4-[[2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetyl]amino]phenyl]butanamide
CID 54830418
2-(3,5-dimethylanilino)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
CID 54813209
N-[3-(4-methylpiperidine-1-carbonyl)phenyl]-2-(4-propoxyanilino)acetamide
CID 54822737
2-[4-(4-methylpiperidine-1-carbonyl)anilino]-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 54830898
N-[4-(azepane-1-carbonyl)phenyl]-2-(4-propoxyanilino)acetamide
CID 54823006
2-(4-bromophenoxy)-N-[4-(4-methylpiperidine-1-carbonyl)phenyl]acetamide
CID 17179624

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide?
The IUPAC name of N-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide (CID 54831051) is N-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide?
The canonical SMILES for N-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide is CCOc1ccc(NC(=O)CNc2ccc(C(=O)N3CCC(C)CC3)cc2)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide?
The InChIKey is TTWOEAZYYIWXKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O3/c1-3-29-21-10-8-20(9-11-21)25-22(27)16-24-19-6-4-18(5-7-19)23(28)26-14-12-17(2)13-15-26/h4-11,17,24H,3,12-16H2,1-2H3,(H,25,27).
What are the key properties of N-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide?
N-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide has a molecular weight of 395.50 g/mol, XLogP of 4.01, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-2-[4-(4-methylpiperidine-1-carbonyl)anilino]acetamide is sourced from PubChem (CID 54831051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).