(2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide

C20H30N2O — CID 125491837

IUPAC(2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide
SMILESCC(C)N1CC[C@H]([C@@](C(N)=O)(c2ccccc2)C2CCCC2)C1
InChIInChI=1S/C20H30N2O/c1-15(2)22-13-12-18(14-22)20(19(21)23,17-10-6-7-11-17)16-8-4-3-5-9-16/h3-5,8-9,15,17-18H,6-7,10-14H2,1-2H3,(H2,21,23)/t18-,20+/m0/s1
InChIKeyMTJMHBZMNZKIRT-AZUAARDMSA-N
MW314.47 g/mol
LogP3.33
Rot. Bonds5

About (2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide

(2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide (PubChem CID 125491837) has the molecular formula C20H30N2O and a molecular weight of 314.47 g/mol. Its IUPAC name is (2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide.

Molecular Properties

Compound Name(2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide
PubChem CID125491837
Molecular FormulaC20H30N2O
Molecular Weight314.47 g/mol
Exact Mass314.24
IUPAC Name(2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide
SMILESCC(C)N1CC[C@H]([C@@](C(N)=O)(c2ccccc2)C2CCCC2)C1
InChIInChI=1S/C20H30N2O/c1-15(2)22-13-12-18(14-22)20(19(21)23,17-10-6-7-11-17)16-8-4-3-5-9-16/h3-5,8-9,15,17-18H,6-7,10-14H2,1-2H3,(H2,21,23)/t18-,20+/m0/s1
InChIKeyMTJMHBZMNZKIRT-AZUAARDMSA-N
XLogP3.33
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.47
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide?
The IUPAC name of (2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide (CID 125491837) is (2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide.
What is the SMILES notation for (2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide?
The canonical SMILES for (2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide is CC(C)N1CC[C@H]([C@@](C(N)=O)(c2ccccc2)C2CCCC2)C1.
What is the InChIKey of (2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide?
The InChIKey is MTJMHBZMNZKIRT-AZUAARDMSA-N. The full InChI is InChI=1S/C20H30N2O/c1-15(2)22-13-12-18(14-22)20(19(21)23,17-10-6-7-11-17)16-8-4-3-5-9-16/h3-5,8-9,15,17-18H,6-7,10-14H2,1-2H3,(H2,21,23)/t18-,20+/m0/s1.
What are the key properties of (2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide?
(2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide has a molecular weight of 314.47 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-cyclopentyl-2-phenyl-2-[(3R)-1-propan-2-ylpyrrolidin-3-yl]acetamide is sourced from PubChem (CID 125491837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).