2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride

C19H22Cl2N2O2 — CID 119552537

IUPAC2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
SMILESCN(C(=O)c1ccccc1OCc1ccc(Cl)cc1)C1CCNC1.Cl
InChIInChI=1S/C19H21ClN2O2.ClH/c1-22(16-10-11-21-12-16)19(23)17-4-2-3-5-18(17)24-13-14-6-8-15(20)9-7-14;/h2-9,16,21H,10-13H2,1H3;1H
InChIKeyQMEZVLQURUWGGJ-UHFFFAOYSA-N
MW381.30 g/mol
LogP3.77
Rot. Bonds5

About 2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride

2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride (PubChem CID 119552537) has the molecular formula C19H22Cl2N2O2 and a molecular weight of 381.30 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride.

Molecular Properties

Compound Name2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
PubChem CID119552537
Molecular FormulaC19H22Cl2N2O2
Molecular Weight381.30 g/mol
Exact Mass380.11
IUPAC Name2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
SMILESCN(C(=O)c1ccccc1OCc1ccc(Cl)cc1)C1CCNC1.Cl
InChIInChI=1S/C19H21ClN2O2.ClH/c1-22(16-10-11-21-12-16)19(23)17-4-2-3-5-18(17)24-13-14-6-8-15(20)9-7-14;/h2-9,16,21H,10-13H2,1H3;1H
InChIKeyQMEZVLQURUWGGJ-UHFFFAOYSA-N
XLogP3.77
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.30
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-phenylmethoxy-N-pyrrolidin-3-ylbenzamide
CID 72544793
2-[(2-bromophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119553751
5-chloro-N-methyl-2-propoxy-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119550406
2-hydroxy-3-methoxy-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 55026964
2-[(4-chlorophenyl)methoxy]-N-piperidin-4-ylbenzamide
CID 119388320
2-(2,4-dichlorophenoxy)-N-methyl-N-pyrrolidin-3-ylpyridine-3-carboxamide;dihydrochloride
CID 119554680
2-methoxy-N-methyl-N-piperidin-4-ylbenzamide
CID 43602173
2-ethoxy-N-ethyl-N-pyrrolidin-3-ylbenzamide
CID 55026177
2,3-difluoro-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119554382
4-(methoxymethyl)-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 119553670
1-[2-[(4-chlorophenyl)methoxy]phenyl]ethanone
CID 2763955
4-methoxy-N-methyl-N-pyrrolidin-3-ylnaphthalene-1-carboxamide;hydrochloride
CID 119552054

Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride?
The IUPAC name of 2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride (CID 119552537) is 2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride.
What is the SMILES notation for 2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride?
The canonical SMILES for 2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride is CN(C(=O)c1ccccc1OCc1ccc(Cl)cc1)C1CCNC1.Cl.
What is the InChIKey of 2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride?
The InChIKey is QMEZVLQURUWGGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O2.ClH/c1-22(16-10-11-21-12-16)19(23)17-4-2-3-5-18(17)24-13-14-6-8-15(20)9-7-14;/h2-9,16,21H,10-13H2,1H3;1H.
What are the key properties of 2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride?
2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride has a molecular weight of 381.30 g/mol, XLogP of 3.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)methoxy]-N-methyl-N-pyrrolidin-3-ylbenzamide;hydrochloride is sourced from PubChem (CID 119552537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).