1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one

C15H27N3O2 — CID 106635944

IUPAC1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one
SMILESCCCN(CC(=O)N1CCCC1=O)CC1CCCCN1
InChIInChI=1S/C15H27N3O2/c1-2-9-17(11-13-6-3-4-8-16-13)12-15(20)18-10-5-7-14(18)19/h13,16H,2-12H2,1H3
InChIKeyCXMOYYZZHRWGOK-UHFFFAOYSA-N
MW281.40 g/mol
LogP0.99
Rot. Bonds6

About 1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one

1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one (PubChem CID 106635944) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one
PubChem CID106635944
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one
SMILESCCCN(CC(=O)N1CCCC1=O)CC1CCCCN1
InChIInChI=1S/C15H27N3O2/c1-2-9-17(11-13-6-3-4-8-16-13)12-15(20)18-10-5-7-14(18)19/h13,16H,2-12H2,1H3
InChIKeyCXMOYYZZHRWGOK-UHFFFAOYSA-N
XLogP0.99
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-[propyl(pyrrolidin-2-ylmethyl)amino]acetyl]pyrrolidin-2-one
CID 106615823
1-[2-[2-methoxyethyl(pyrrolidin-2-ylmethyl)amino]acetyl]pyrrolidin-2-one
CID 106617590
1-(4-methylpiperazin-1-yl)-2-[piperidin-2-ylmethyl(propyl)amino]ethanone
CID 106636149
2-[piperidin-2-ylmethyl(propyl)amino]-N-propylacetamide
CID 106636145
N-(2-methylbutan-2-yl)-2-[piperidin-2-ylmethyl(propyl)amino]acetamide
CID 106635885
1-[2-[2-methoxyethyl(pyrrolidin-2-ylmethyl)amino]acetyl]imidazolidin-2-one
CID 106617628
1-[2-[propyl(pyrrolidin-2-ylmethyl)amino]ethyl]pyrrolidine-2,5-dione
CID 106615759
N-(ethylcarbamoyl)-2-[piperidin-2-ylmethyl(propyl)amino]acetamide
CID 106636038
N-tert-butyl-2-[propyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106616037
2-[propyl(pyrrolidin-2-ylmethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 106615942
2-[piperidin-2-ylmethyl(propyl)amino]-N-(propylcarbamoyl)acetamide
CID 106635938
N-(2-cyanoethyl)-2-[piperidin-2-ylmethyl(propyl)amino]acetamide
CID 106636144

Frequently Asked Questions

What is the IUPAC name of 1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one?
The IUPAC name of 1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one (CID 106635944) is 1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one?
The canonical SMILES for 1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one is CCCN(CC(=O)N1CCCC1=O)CC1CCCCN1.
What is the InChIKey of 1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one?
The InChIKey is CXMOYYZZHRWGOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-2-9-17(11-13-6-3-4-8-16-13)12-15(20)18-10-5-7-14(18)19/h13,16H,2-12H2,1H3.
What are the key properties of 1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one?
1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one has a molecular weight of 281.40 g/mol, XLogP of 0.99, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[piperidin-2-ylmethyl(propyl)amino]acetyl]pyrrolidin-2-one is sourced from PubChem (CID 106635944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).