N-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide

C19H27N3O3 — CID 113130996

IUPACN-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide
SMILESCC(=O)Nc1cccc(N(CCC(=O)N2CCCC(C)C2)C(C)=O)c1
InChIInChI=1S/C19H27N3O3/c1-14-6-5-10-21(13-14)19(25)9-11-22(16(3)24)18-8-4-7-17(12-18)20-15(2)23/h4,7-8,12,14H,5-6,9-11,13H2,1-3H3,(H,20,23)
InChIKeyDVYDVVKWBGVVOJ-UHFFFAOYSA-N
MW345.44 g/mol
LogP2.65
Rot. Bonds5

About N-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide

N-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide (PubChem CID 113130996) has the molecular formula C19H27N3O3 and a molecular weight of 345.44 g/mol. Its IUPAC name is N-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide
PubChem CID113130996
Molecular FormulaC19H27N3O3
Molecular Weight345.44 g/mol
Exact Mass345.21
IUPAC NameN-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide
SMILESCC(=O)Nc1cccc(N(CCC(=O)N2CCCC(C)C2)C(C)=O)c1
InChIInChI=1S/C19H27N3O3/c1-14-6-5-10-21(13-14)19(25)9-11-22(16(3)24)18-8-4-7-17(12-18)20-15(2)23/h4,7-8,12,14H,5-6,9-11,13H2,1-3H3,(H,20,23)
InChIKeyDVYDVVKWBGVVOJ-UHFFFAOYSA-N
XLogP2.65
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide
CID 113131128
N-(2-fluorophenyl)-N-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]acetamide
CID 113126709
N-(4-chloro-2-methylphenyl)-N-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]acetamide
CID 113127873
N-(3-fluorophenyl)-N-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]acetamide
CID 113132344
N-(2,5-dichlorophenyl)-N-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]acetamide
CID 113133995
N-(3-methoxyphenyl)-N-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]acetamide
CID 113173376
3-(3-acetylanilino)-1-(3-methylpiperidin-1-yl)propan-1-one
CID 109032867
N-(3-fluorophenyl)-N-(3-oxo-3-piperidin-1-ylpropyl)acetamide
CID 113132342
N-(3-oxo-3-pyrrolidin-1-ylpropyl)-N-phenylacetamide
CID 113123338
N-(3-methylphenyl)-N-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]methanesulfonamide
CID 113141792
3-(3-acetamido-N-acetylanilino)-N-tert-butylpropanamide
CID 113130989
3-(3-acetamido-N-acetylanilino)-N-methyl-N-phenylpropanamide
CID 113131003

Frequently Asked Questions

What is the IUPAC name of N-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide?
The IUPAC name of N-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide (CID 113130996) is N-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide.
What is the SMILES notation for N-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide?
The canonical SMILES for N-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide is CC(=O)Nc1cccc(N(CCC(=O)N2CCCC(C)C2)C(C)=O)c1.
What is the InChIKey of N-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide?
The InChIKey is DVYDVVKWBGVVOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O3/c1-14-6-5-10-21(13-14)19(25)9-11-22(16(3)24)18-8-4-7-17(12-18)20-15(2)23/h4,7-8,12,14H,5-6,9-11,13H2,1-3H3,(H,20,23).
What are the key properties of N-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide?
N-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide has a molecular weight of 345.44 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[acetyl-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]amino]phenyl]acetamide is sourced from PubChem (CID 113130996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).