N-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide

C18H31N3O2 — CID 45251324

IUPACN-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide
SMILESO=C(CN1CCCCC1)NC1CC(=O)N(C2CCCCCC2)C1
InChIInChI=1S/C18H31N3O2/c22-17(14-20-10-6-3-7-11-20)19-15-12-18(23)21(13-15)16-8-4-1-2-5-9-16/h15-16H,1-14H2,(H,19,22)
InChIKeyGHPUWMOICDEPBD-UHFFFAOYSA-N
MW321.47 g/mol
LogP1.91
Rot. Bonds4

About N-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide

N-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide (PubChem CID 45251324) has the molecular formula C18H31N3O2 and a molecular weight of 321.47 g/mol. Its IUPAC name is N-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide.

Molecular Properties

Compound NameN-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide
PubChem CID45251324
Molecular FormulaC18H31N3O2
Molecular Weight321.47 g/mol
Exact Mass321.24
IUPAC NameN-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide
SMILESO=C(CN1CCCCC1)NC1CC(=O)N(C2CCCCCC2)C1
InChIInChI=1S/C18H31N3O2/c22-17(14-20-10-6-3-7-11-20)19-15-12-18(23)21(13-15)16-8-4-1-2-5-9-16/h15-16H,1-14H2,(H,19,22)
InChIKeyGHPUWMOICDEPBD-UHFFFAOYSA-N
XLogP1.91
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.47
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Pyrrolidinecarboxamide, N-(4-(2,6-dimethyl-1-piperidinyl)-2-butynyl)-5-oxo-, (S)-
CID 338466
2-(2-methyl-5-oxo-1-pyrrolidinyl)-N-[2-(1-piperidinyl)propyl]acetamide
CID 21327783
cis-N-[2-(2,6-dimethyl-1-piperidinyl)ethyl]-2-oxo-1-pyrrolidineacetamide
CID 44374502
N-[2-(2,6-dimethyl-1-piperidinyl)ethyl]-2-(2-methyl-5-oxo-1-pyrrolidinyl)acetamide
CID 44374529
2-(2-Oxopyrrolidin-1-yl)-N-[2-(piperidin-1-yl)ethyl]acetamide
CID 44374683
Cyclopropanecarboxylic acid (8-carbamoylmethyl-8-aza-bicyclo[3.2.1]oct-3-yl)-amide
CID 650271
N-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-(2-oxopyrrolidin-1-yl)propanamide
CID 21327793
N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-2-(2-oxopyrrolidin-1-yl)propanamide
CID 21327810
2-(2,2-dimethyl-5-oxopyrrolidin-1-yl)-N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]acetamide
CID 44374475
N-[2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]ethyl]-2-(2-oxopyrrolidin-1-yl)acetamide
CID 44374491
N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-2-(2-ethyl-5-oxopyrrolidin-1-yl)acetamide
CID 44374530
N-[2-(2,6-dimethylpiperidin-1-yl)ethyl]-3-(2-oxopyrrolidin-1-yl)propanamide
CID 44374571

Frequently Asked Questions

What is the IUPAC name of N-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide?
The IUPAC name of N-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide (CID 45251324) is N-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide.
What is the SMILES notation for N-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide?
The canonical SMILES for N-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide is O=C(CN1CCCCC1)NC1CC(=O)N(C2CCCCCC2)C1.
What is the InChIKey of N-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide?
The InChIKey is GHPUWMOICDEPBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N3O2/c22-17(14-20-10-6-3-7-11-20)19-15-12-18(23)21(13-15)16-8-4-1-2-5-9-16/h15-16H,1-14H2,(H,19,22).
What are the key properties of N-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide?
N-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide has a molecular weight of 321.47 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cycloheptyl-5-oxopyrrolidin-3-yl)-2-piperidin-1-ylacetamide is sourced from PubChem (CID 45251324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).