N-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide

C19H26N2O3 — CID 91917797

IUPACN-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide
SMILESCOc1cccc(CCC(=O)N2CCC(CC(=O)NC3CC3)C2)c1
InChIInChI=1S/C19H26N2O3/c1-24-17-4-2-3-14(11-17)5-8-19(23)21-10-9-15(13-21)12-18(22)20-16-6-7-16/h2-4,11,15-16H,5-10,12-13H2,1H3,(H,20,22)
InChIKeyADXARXJLYMLJTH-UHFFFAOYSA-N
MW330.43 g/mol
LogP2.14
Rot. Bonds7

About N-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide

N-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide (PubChem CID 91917797) has the molecular formula C19H26N2O3 and a molecular weight of 330.43 g/mol. Its IUPAC name is N-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide
PubChem CID91917797
Molecular FormulaC19H26N2O3
Molecular Weight330.43 g/mol
Exact Mass330.19
IUPAC NameN-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide
SMILESCOc1cccc(CCC(=O)N2CCC(CC(=O)NC3CC3)C2)c1
InChIInChI=1S/C19H26N2O3/c1-24-17-4-2-3-14(11-17)5-8-19(23)21-10-9-15(13-21)12-18(22)20-16-6-7-16/h2-4,11,15-16H,5-10,12-13H2,1H3,(H,20,22)
InChIKeyADXARXJLYMLJTH-UHFFFAOYSA-N
XLogP2.14
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 10104923
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CID 10704222
CID 10704222
CID 73346080
CID 73346080
CID 73353637
CID 73353637
CID 91895807
CID 91895807
CID 16094585
CID 16094585
CID 56665606
CID 56665606
CID 71458561
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CID 155531392
CID 155531392

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide?
The IUPAC name of N-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide (CID 91917797) is N-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide is COc1cccc(CCC(=O)N2CCC(CC(=O)NC3CC3)C2)c1.
What is the InChIKey of N-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide?
The InChIKey is ADXARXJLYMLJTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3/c1-24-17-4-2-3-14(11-17)5-8-19(23)21-10-9-15(13-21)12-18(22)20-16-6-7-16/h2-4,11,15-16H,5-10,12-13H2,1H3,(H,20,22).
What are the key properties of N-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide?
N-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide has a molecular weight of 330.43 g/mol, XLogP of 2.14, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[1-[3-(3-methoxyphenyl)propanoyl]pyrrolidin-3-yl]acetamide is sourced from PubChem (CID 91917797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).