(2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide

C22H29N3O2 — CID 25388633

IUPAC(2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide
SMILESCOc1cccc(NC(=O)[C@@H](C)Nc2ccc(N3CCC(C)CC3)cc2)c1
InChIInChI=1S/C22H29N3O2/c1-16-11-13-25(14-12-16)20-9-7-18(8-10-20)23-17(2)22(26)24-19-5-4-6-21(15-19)27-3/h4-10,15-17,23H,11-14H2,1-3H3,(H,24,26)/t17-/m1/s1
InChIKeyOCTGDZBTCHAUJB-QGZVFWFLSA-N
MW367.49 g/mol
LogP4.37
Rot. Bonds6

About (2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide

(2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide (PubChem CID 25388633) has the molecular formula C22H29N3O2 and a molecular weight of 367.49 g/mol. Its IUPAC name is (2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide.

Molecular Properties

Compound Name(2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide
PubChem CID25388633
Molecular FormulaC22H29N3O2
Molecular Weight367.49 g/mol
Exact Mass367.23
IUPAC Name(2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide
SMILESCOc1cccc(NC(=O)[C@@H](C)Nc2ccc(N3CCC(C)CC3)cc2)c1
InChIInChI=1S/C22H29N3O2/c1-16-11-13-25(14-12-16)20-9-7-18(8-10-20)23-17(2)22(26)24-19-5-4-6-21(15-19)27-3/h4-10,15-17,23H,11-14H2,1-3H3,(H,24,26)/t17-/m1/s1
InChIKeyOCTGDZBTCHAUJB-QGZVFWFLSA-N
XLogP4.37
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.49
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze (2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide 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

(2R)-N-(3-fluorophenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide
CID 25352661
(2S)-N-(2,5-dimethoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide
CID 25351726
(2S)-N-[3-(dimethylsulfamoyl)phenyl]-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide
CID 25352078
4-(4-fluorophenyl)-N-[(2R)-1-(3-methoxyanilino)-1-oxopropan-2-yl]piperazine-1-carboxamide
CID 95395014
(2S)-N-(3-methoxyphenyl)-2-phenyl-2-(4-piperidin-1-ylanilino)acetamide
CID 25362284
N-(3-methoxyphenyl)-5-(4-methylpiperidin-1-yl)pyridine-3-carboxamide
CID 109227296
N'-(4-methoxyphenyl)-N-[4-(4-methylpiperidin-1-yl)phenyl]oxamide
CID 108987256
N-cyclopropyl-2-(3-methoxyanilino)propanamide
CID 43085846
(2R)-2-[4-(4-ethylpiperazin-1-yl)anilino]-N-(3-methoxyphenyl)-2-phenylacetamide
CID 31420058
2-(4-methoxyanilino)-N-(3-methylphenyl)propanamide
CID 46757337
2-amino-N-[4-(4-methylpiperidin-1-yl)phenyl]propanamide
CID 60719278
1-(3-methoxyphenyl)-3-[4-(4-methylpiperazin-1-yl)phenyl]urea
CID 48740743

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide?
The IUPAC name of (2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide (CID 25388633) is (2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide.
What is the SMILES notation for (2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide?
The canonical SMILES for (2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide is COc1cccc(NC(=O)[C@@H](C)Nc2ccc(N3CCC(C)CC3)cc2)c1.
What is the InChIKey of (2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide?
The InChIKey is OCTGDZBTCHAUJB-QGZVFWFLSA-N. The full InChI is InChI=1S/C22H29N3O2/c1-16-11-13-25(14-12-16)20-9-7-18(8-10-20)23-17(2)22(26)24-19-5-4-6-21(15-19)27-3/h4-10,15-17,23H,11-14H2,1-3H3,(H,24,26)/t17-/m1/s1.
What are the key properties of (2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide?
(2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide has a molecular weight of 367.49 g/mol, XLogP of 4.37, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-methoxyphenyl)-2-[4-(4-methylpiperidin-1-yl)anilino]propanamide is sourced from PubChem (CID 25388633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).