N-cycloheptyl-3-oxopiperazine-1-carboxamide

C12H21N3O2 — CID 119103460

IUPACN-cycloheptyl-3-oxopiperazine-1-carboxamide
SMILESO=C1CN(C(=O)NC2CCCCCC2)CCN1
InChIInChI=1S/C12H21N3O2/c16-11-9-15(8-7-13-11)12(17)14-10-5-3-1-2-4-6-10/h10H,1-9H2,(H,13,16)(H,14,17)
InChIKeyQUZQSDSIDYTKMG-UHFFFAOYSA-N
MW239.32 g/mol
LogP0.85
Rot. Bonds1

About N-cycloheptyl-3-oxopiperazine-1-carboxamide

N-cycloheptyl-3-oxopiperazine-1-carboxamide (PubChem CID 119103460) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is N-cycloheptyl-3-oxopiperazine-1-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-3-oxopiperazine-1-carboxamide
PubChem CID119103460
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC NameN-cycloheptyl-3-oxopiperazine-1-carboxamide
SMILESO=C1CN(C(=O)NC2CCCCCC2)CCN1
InChIInChI=1S/C12H21N3O2/c16-11-9-15(8-7-13-11)12(17)14-10-5-3-1-2-4-6-10/h10H,1-9H2,(H,13,16)(H,14,17)
InChIKeyQUZQSDSIDYTKMG-UHFFFAOYSA-N
XLogP0.85
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-methylsulfonylpiperidin-3-yl)-3-oxopiperazine-1-carboxamide
CID 47766348
N-cyclopentyl-3-oxopyrrolidine-1-carboxamide
CID 130826752
N-methyl-3-oxopiperazine-1-carboxamide
CID 53017571
N-cycloheptylpiperidine-1-carboxamide
CID 54054704
N-ethyl-3-oxopiperazine-1-carboxamide
CID 53017572
N-cyclopentyl-1-methyl-9-oxo-1,4,10-triazaspiro[5.6]dodecane-4-carboxamide
CID 72870632
N-cyclohexyl-5-methyl-3,6-dihydro-2H-pyridine-1-carboxamide
CID 106313541
1-(cyclohexylcarbamoyl)-5-oxopiperazine-2-carboxylic acid
CID 107435082
4-[2-(cyclopentylamino)acetyl]-1,4-diazepan-2-one
CID 65366267
N-cyclohexyl-3-[[4-[(3-oxopiperazin-1-yl)methyl]triazol-1-yl]methyl]piperidine-1-carboxamide
CID 45238233
4-acetylpiperazin-2-one
CID 12744517
N-cyclohexyl-3-(2,5-dioxoimidazolidin-1-yl)azetidine-1-carboxamide
CID 121159553

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-3-oxopiperazine-1-carboxamide?
The IUPAC name of N-cycloheptyl-3-oxopiperazine-1-carboxamide (CID 119103460) is N-cycloheptyl-3-oxopiperazine-1-carboxamide.
What is the SMILES notation for N-cycloheptyl-3-oxopiperazine-1-carboxamide?
The canonical SMILES for N-cycloheptyl-3-oxopiperazine-1-carboxamide is O=C1CN(C(=O)NC2CCCCCC2)CCN1.
What is the InChIKey of N-cycloheptyl-3-oxopiperazine-1-carboxamide?
The InChIKey is QUZQSDSIDYTKMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c16-11-9-15(8-7-13-11)12(17)14-10-5-3-1-2-4-6-10/h10H,1-9H2,(H,13,16)(H,14,17).
What are the key properties of N-cycloheptyl-3-oxopiperazine-1-carboxamide?
N-cycloheptyl-3-oxopiperazine-1-carboxamide has a molecular weight of 239.32 g/mol, XLogP of 0.85, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-3-oxopiperazine-1-carboxamide is sourced from PubChem (CID 119103460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).