4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide

C17H26N2O3 — CID 120575755

IUPAC4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide
SMILESCOCCCOc1ccc(C(=O)NC2CCCNC2C)cc1
InChIInChI=1S/C17H26N2O3/c1-13-16(5-3-10-18-13)19-17(20)14-6-8-15(9-7-14)22-12-4-11-21-2/h6-9,13,16,18H,3-5,10-12H2,1-2H3,(H,19,20)
InChIKeyLOCIFXKVUUGSIN-UHFFFAOYSA-N
MW306.41 g/mol
LogP1.97
Rot. Bonds7

About 4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide

4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide (PubChem CID 120575755) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is 4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide.

Molecular Properties

Compound Name4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide
PubChem CID120575755
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide
SMILESCOCCCOc1ccc(C(=O)NC2CCCNC2C)cc1
InChIInChI=1S/C17H26N2O3/c1-13-16(5-3-10-18-13)19-17(20)14-6-8-15(9-7-14)22-12-4-11-21-2/h6-9,13,16,18H,3-5,10-12H2,1-2H3,(H,19,20)
InChIKeyLOCIFXKVUUGSIN-UHFFFAOYSA-N
XLogP1.97
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide 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

4-(cyclopropylmethoxy)-N-(2-methylpiperidin-3-yl)benzamide;hydrochloride
CID 120574690
4-(2-methoxyethylsulfamoyl)-N-(2-methylpiperidin-3-yl)benzamide
CID 120574271
N-[(2R,3R)-2-methylpiperidin-3-yl]benzamide
CID 124511336
2-[4-(2-methoxyethoxy)phenyl]-5-methyl-N-(2-methylpiperidin-3-yl)triazole-4-carboxamide
CID 120573390
5-methoxy-N-(2-methylpiperidin-3-yl)pentanamide;hydrochloride
CID 120575880
4-ethylsulfonyl-N-(2-methylpiperidin-3-yl)benzamide
CID 120574136
4-(2-methoxyethoxy)-N-(2-methylpiperidin-3-yl)benzenesulfonamide
CID 120726698
N-(2-methylpiperidin-3-yl)-5-(4-methylsulfonylphenoxy)pentanamide;hydrochloride
CID 120575876
1-N-(2,2-dimethylpropyl)-4-N-(2-methylpiperidin-3-yl)benzene-1,4-dicarboxamide;hydrochloride
CID 120575205
4-butoxy-3-chloro-5-methoxy-N-(2-methylpiperidin-3-yl)benzamide
CID 120577293
2-(4-methylphenoxy)-N-(2-methylpiperidin-3-yl)acetamide
CID 120576127
3-bromo-4-methoxy-N-(2-methylpiperidin-3-yl)benzamide
CID 114694855

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide?
The IUPAC name of 4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide (CID 120575755) is 4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide.
What is the SMILES notation for 4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide?
The canonical SMILES for 4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide is COCCCOc1ccc(C(=O)NC2CCCNC2C)cc1.
What is the InChIKey of 4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide?
The InChIKey is LOCIFXKVUUGSIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-13-16(5-3-10-18-13)19-17(20)14-6-8-15(9-7-14)22-12-4-11-21-2/h6-9,13,16,18H,3-5,10-12H2,1-2H3,(H,19,20).
What are the key properties of 4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide?
4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide has a molecular weight of 306.41 g/mol, XLogP of 1.97, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxypropoxy)-N-(2-methylpiperidin-3-yl)benzamide is sourced from PubChem (CID 120575755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).