4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide

C20H25N3O2 — CID 136514299

IUPAC4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide
SMILESCOc1ccccc1N1CCC(NC(=O)c2ccc(N(C)C)cc2)C1
InChIInChI=1S/C20H25N3O2/c1-22(2)17-10-8-15(9-11-17)20(24)21-16-12-13-23(14-16)18-6-4-5-7-19(18)25-3/h4-11,16H,12-14H2,1-3H3,(H,21,24)
InChIKeyZGGHGLDIWUPQKD-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.77
Rot. Bonds5

About 4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide

4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide (PubChem CID 136514299) has the molecular formula C20H25N3O2 and a molecular weight of 339.44 g/mol. Its IUPAC name is 4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide
PubChem CID136514299
Molecular FormulaC20H25N3O2
Molecular Weight339.44 g/mol
Exact Mass339.19
IUPAC Name4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide
SMILESCOc1ccccc1N1CCC(NC(=O)c2ccc(N(C)C)cc2)C1
InChIInChI=1S/C20H25N3O2/c1-22(2)17-10-8-15(9-11-17)20(24)21-16-12-13-23(14-16)18-6-4-5-7-19(18)25-3/h4-11,16H,12-14H2,1-3H3,(H,21,24)
InChIKeyZGGHGLDIWUPQKD-UHFFFAOYSA-N
XLogP2.77
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(2-methoxyphenyl)piperidin-3-yl]-3,4-dimethylbenzamide
CID 86965644
4-(dimethylamino)-N-(1-phenylpiperidin-4-yl)benzamide
CID 110745886
2,2,2-trifluoro-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]acetamide
CID 136514261
(2S)-2-[[(3S)-1-(2-methoxyphenyl)pyrrolidin-3-yl]carbamoylamino]-N,N-dimethylpropanamide
CID 124609038
N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxamide
CID 71921034
(1S,5R)-N-[(3R)-1-(2-methoxyphenyl)pyrrolidin-3-yl]bicyclo[3.1.0]hexane-6-carboxamide
CID 100876121
N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]-3-methylpyridazine-4-carboxamide
CID 136517434
N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]-2-methyl-3-(methylamino)propanamide
CID 119895369
3-amino-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]-2-methylbutanamide;dihydrochloride
CID 120504219
2-(cyclopropylmethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]acetamide;dihydrochloride
CID 119895364
N-[1-(2-methoxyphenyl)piperidin-4-yl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 49204925
N-[(3S)-1-(2-methoxyphenyl)pyrrolidin-3-yl]-3-(triazol-1-yl)benzamide
CID 97243982

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide?
The IUPAC name of 4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide (CID 136514299) is 4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide?
The canonical SMILES for 4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide is COc1ccccc1N1CCC(NC(=O)c2ccc(N(C)C)cc2)C1.
What is the InChIKey of 4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide?
The InChIKey is ZGGHGLDIWUPQKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O2/c1-22(2)17-10-8-15(9-11-17)20(24)21-16-12-13-23(14-16)18-6-4-5-7-19(18)25-3/h4-11,16H,12-14H2,1-3H3,(H,21,24).
What are the key properties of 4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide?
4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide has a molecular weight of 339.44 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-[1-(2-methoxyphenyl)pyrrolidin-3-yl]benzamide is sourced from PubChem (CID 136514299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).