N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide

C17H26N2O2 — CID 106612263

IUPACN-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide
SMILESCCCCN(CC1CCCN1)C(=O)c1ccccc1OC
InChIInChI=1S/C17H26N2O2/c1-3-4-12-19(13-14-8-7-11-18-14)17(20)15-9-5-6-10-16(15)21-2/h5-6,9-10,14,18H,3-4,7-8,11-13H2,1-2H3
InChIKeyBSGJFEPXLNQFMK-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.69
Rot. Bonds7

About N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide

N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide (PubChem CID 106612263) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide.

Molecular Properties

Compound NameN-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide
PubChem CID106612263
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide
SMILESCCCCN(CC1CCCN1)C(=O)c1ccccc1OC
InChIInChI=1S/C17H26N2O2/c1-3-4-12-19(13-14-8-7-11-18-14)17(20)15-9-5-6-10-16(15)21-2/h5-6,9-10,14,18H,3-4,7-8,11-13H2,1-2H3
InChIKeyBSGJFEPXLNQFMK-UHFFFAOYSA-N
XLogP2.69
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)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

N-(2-hydroxyethyl)-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106612911
N-butyl-2-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106612351
N-butyl-2-methylsulfanyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106612084
N-butyl-5-fluoro-2-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106611857
2,5-dibromo-N-butyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106612246
N-butyl-2,4-dichloro-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106611844
N-butyl-3-chloro-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106612004
N-butyl-3-chloro-N-(pyrrolidin-2-ylmethyl)pyridine-4-carboxamide
CID 106611897
5-chloro-N-ethyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106609149
N-butyl-4-cyano-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106612332
N-butyl-3-methoxy-N-(pyrrolidin-2-ylmethyl)propanamide
CID 106612022
N-butyl-2-phenylsulfanyl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106612016

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide?
The IUPAC name of N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide (CID 106612263) is N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide.
What is the SMILES notation for N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide?
The canonical SMILES for N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide is CCCCN(CC1CCCN1)C(=O)c1ccccc1OC.
What is the InChIKey of N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide?
The InChIKey is BSGJFEPXLNQFMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-3-4-12-19(13-14-8-7-11-18-14)17(20)15-9-5-6-10-16(15)21-2/h5-6,9-10,14,18H,3-4,7-8,11-13H2,1-2H3.
What are the key properties of N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide?
N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide has a molecular weight of 290.41 g/mol, XLogP of 2.69, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-methoxy-N-(pyrrolidin-2-ylmethyl)benzamide is sourced from PubChem (CID 106612263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).