N-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide

C22H24N2O3 — CID 134800399

IUPACN-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide
SMILESCOc1cccc(-c2cccc(C(=O)N3CCCC3C(=O)NC3CC3)c2)c1
InChIInChI=1S/C22H24N2O3/c1-27-19-8-3-6-16(14-19)15-5-2-7-17(13-15)22(26)24-12-4-9-20(24)21(25)23-18-10-11-18/h2-3,5-8,13-14,18,20H,4,9-12H2,1H3,(H,23,25)
InChIKeyFIHLOTGCQUDWST-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.25
Rot. Bonds5

About N-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide

N-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide (PubChem CID 134800399) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is N-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide
PubChem CID134800399
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC NameN-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide
SMILESCOc1cccc(-c2cccc(C(=O)N3CCCC3C(=O)NC3CC3)c2)c1
InChIInChI=1S/C22H24N2O3/c1-27-19-8-3-6-16(14-19)15-5-2-7-17(13-15)22(26)24-12-4-9-20(24)21(25)23-18-10-11-18/h2-3,5-8,13-14,18,20H,4,9-12H2,1H3,(H,23,25)
InChIKeyFIHLOTGCQUDWST-UHFFFAOYSA-N
XLogP3.25
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-benzylpiperidin-4-yl)-1-(3-methoxybenzoyl)pyrrolidine-2-carboxamide
CID 42696104
(2R)-1-(3-chlorobenzoyl)-N-[4-[(4-methoxybenzoyl)amino]cyclohexyl]pyrrolidine-2-carboxamide
CID 24717437
methyl (2S)-1-(3-methoxybenzoyl)pyrrolidine-2-carboxylate
CID 22212303
methyl 1-(3-methoxybenzoyl)pyrrolidine-2-carboxylate
CID 531501
N-cyclopropyl-1-(3-iodobenzoyl)pyrrolidine-2-carboxamide
CID 47158356
(2S)-1-(3-methoxybenzoyl)-N-phenylpyrrolidine-2-carboxamide
CID 28828175
(2R)-1-(3-methoxybenzoyl)-N-phenylpyrrolidine-2-carboxamide
CID 28828173
N-cyclopentyl-1-(3-pyridin-2-ylbenzoyl)pyrrolidine-2-carboxamide
CID 134799641
(2R)-1-(3-methoxybenzoyl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)pyrrolidine-2-carboxamide
CID 7412166
(2S)-2-N-cyclopentyl-1-N-(3-methoxyphenyl)pyrrolidine-1,2-dicarboxamide
CID 1433458
(2S)-1-(3-fluorobenzoyl)-N-(3-methoxyphenyl)pyrrolidine-2-carboxamide
CID 51606138
N-cyclopropyl-1-[3-[(2-methylcyclopropanecarbonyl)amino]benzoyl]pyrrolidine-2-carboxamide
CID 86982588

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide?
The IUPAC name of N-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide (CID 134800399) is N-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide is COc1cccc(-c2cccc(C(=O)N3CCCC3C(=O)NC3CC3)c2)c1.
What is the InChIKey of N-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide?
The InChIKey is FIHLOTGCQUDWST-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-27-19-8-3-6-16(14-19)15-5-2-7-17(13-15)22(26)24-12-4-9-20(24)21(25)23-18-10-11-18/h2-3,5-8,13-14,18,20H,4,9-12H2,1H3,(H,23,25).
What are the key properties of N-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide?
N-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide has a molecular weight of 364.45 g/mol, XLogP of 3.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 134800399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).