N-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide

C14H20N2O2 — CID 88546944

IUPACN-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide
SMILESCON(CCN1CCCC1)C(=O)c1ccccc1
InChIInChI=1S/C14H20N2O2/c1-18-16(12-11-15-9-5-6-10-15)14(17)13-7-3-2-4-8-13/h2-4,7-8H,5-6,9-12H2,1H3
InChIKeyRWRGQTSBPNCZML-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.79
Rot. Bonds5

About N-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide

N-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide (PubChem CID 88546944) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide.

Molecular Properties

Compound NameN-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide
PubChem CID88546944
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide
SMILESCON(CCN1CCCC1)C(=O)c1ccccc1
InChIInChI=1S/C14H20N2O2/c1-18-16(12-11-15-9-5-6-10-15)14(17)13-7-3-2-4-8-13/h2-4,7-8H,5-6,9-12H2,1H3
InChIKeyRWRGQTSBPNCZML-UHFFFAOYSA-N
XLogP1.79
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

methyl N-phenyl-N-(2-pyrrolidin-1-ylethyl)carbamate
CID 142235373
N-methyl-N-(2-piperazin-1-ylethyl)benzamide
CID 63265460
2-[methyl(2-pyrrolidin-1-ylethyl)amino]-1-phenylbutan-1-one
CID 63207872
1-(3-methoxyphenyl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]ethanone
CID 63207254
N-methyl-N-(2-piperidin-1-ylethyl)pyridine-4-carboxamide
CID 110753397
N-methyl-4-[1-(2-phenylethyl)piperidin-4-yl]oxy-N-(2-pyrrolidin-1-ylethyl)benzamide
CID 25301725
N-methyl-N-(2-pyrrolidin-1-ylethyl)aniline
CID 69244410
1-(4-methoxyphenyl)-2-[methyl(2-pyrrolidin-1-ylethyl)amino]propan-1-one
CID 63207477
2-(azepan-1-yl)-N-benzyl-N-methylethanamine
CID 54806241
N,2-diphenyl-N-(2-piperidin-1-ylethyl)acetamide
CID 23882390
N-methyl-4-[1-(2-phenylethyl)piperidin-4-yl]oxy-N-(2-piperidin-1-ylethyl)benzamide
CID 42527447
2-fluoro-N-methyl-N-(2-piperidin-1-ylethyl)benzamide
CID 110753364

Frequently Asked Questions

What is the IUPAC name of N-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide?
The IUPAC name of N-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide (CID 88546944) is N-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide.
What is the SMILES notation for N-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide?
The canonical SMILES for N-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide is CON(CCN1CCCC1)C(=O)c1ccccc1.
What is the InChIKey of N-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide?
The InChIKey is RWRGQTSBPNCZML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-18-16(12-11-15-9-5-6-10-15)14(17)13-7-3-2-4-8-13/h2-4,7-8H,5-6,9-12H2,1H3.
What are the key properties of N-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide?
N-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide has a molecular weight of 248.33 g/mol, XLogP of 1.79, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-(2-pyrrolidin-1-ylethyl)benzamide is sourced from PubChem (CID 88546944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).