2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide

C19H29N3O — CID 3052196

IUPAC2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide
SMILESO=C(NCCN1CCCC1)C(c1ccccc1)N1CCCCC1
InChIInChI=1S/C19H29N3O/c23-19(20-11-16-21-12-7-8-13-21)18(17-9-3-1-4-10-17)22-14-5-2-6-15-22/h1,3-4,9-10,18H,2,5-8,11-16H2,(H,20,23)
InChIKeyDGTNZWVKKHSDGI-UHFFFAOYSA-N
MW315.46 g/mol
LogP2.43
Rot. Bonds6

About 2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide

2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide (PubChem CID 3052196) has the molecular formula C19H29N3O and a molecular weight of 315.46 g/mol. Its IUPAC name is 2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide.

Molecular Properties

Compound Name2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide
PubChem CID3052196
Molecular FormulaC19H29N3O
Molecular Weight315.46 g/mol
Exact Mass315.23
IUPAC Name2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide
SMILESO=C(NCCN1CCCC1)C(c1ccccc1)N1CCCCC1
InChIInChI=1S/C19H29N3O/c23-19(20-11-16-21-12-7-8-13-21)18(17-9-3-1-4-10-17)22-14-5-2-6-15-22/h1,3-4,9-10,18H,2,5-8,11-16H2,(H,20,23)
InChIKeyDGTNZWVKKHSDGI-UHFFFAOYSA-N
XLogP2.43
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.46
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide?
The IUPAC name of 2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide (CID 3052196) is 2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide.
What is the SMILES notation for 2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide?
The canonical SMILES for 2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide is O=C(NCCN1CCCC1)C(c1ccccc1)N1CCCCC1.
What is the InChIKey of 2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide?
The InChIKey is DGTNZWVKKHSDGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O/c23-19(20-11-16-21-12-7-8-13-21)18(17-9-3-1-4-10-17)22-14-5-2-6-15-22/h1,3-4,9-10,18H,2,5-8,11-16H2,(H,20,23).
What are the key properties of 2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide?
2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide has a molecular weight of 315.46 g/mol, XLogP of 2.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-piperidin-1-yl-N-(2-pyrrolidin-1-ylethyl)acetamide is sourced from PubChem (CID 3052196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).