N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide

C13H22N2O3 — CID 167682160

IUPACN-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide
SMILESCNC(=O)CCCCC(=O)CN1CCCCC1=O
InChIInChI=1S/C13H22N2O3/c1-14-12(17)7-3-2-6-11(16)10-15-9-5-4-8-13(15)18/h2-10H2,1H3,(H,14,17)
InChIKeyVRUSMTNGESCMBZ-UHFFFAOYSA-N
MW254.33 g/mol
LogP0.87
Rot. Bonds7

About N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide

N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide (PubChem CID 167682160) has the molecular formula C13H22N2O3 and a molecular weight of 254.33 g/mol. Its IUPAC name is N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide.

Molecular Properties

Compound NameN-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide
PubChem CID167682160
Molecular FormulaC13H22N2O3
Molecular Weight254.33 g/mol
Exact Mass254.16
IUPAC NameN-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide
SMILESCNC(=O)CCCCC(=O)CN1CCCCC1=O
InChIInChI=1S/C13H22N2O3/c1-14-12(17)7-3-2-6-11(16)10-15-9-5-4-8-13(15)18/h2-10H2,1H3,(H,14,17)
InChIKeyVRUSMTNGESCMBZ-UHFFFAOYSA-N
XLogP0.87
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-oxopentyl)pyrrolidin-2-one
CID 62043134
2-(2-oxopiperidin-1-yl)-N-propan-2-ylacetamide
CID 110689762
1-(3-methoxy-2-oxopropyl)piperidin-2-one
CID 107507681
2-(2-oxopiperidin-1-yl)acetate
CID 18981165
2-(2-oxopyrrolidin-1-yl)ethanethioic S-acid
CID 57303794
2-(2-oxopiperidin-1-yl)-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
CID 86984731
2-hydroxy-2-methyl-3-[[2-(2-oxoazepan-1-yl)acetyl]amino]propanoic acid
CID 66173577
2-[[2-(2-oxoazocan-1-yl)acetyl]amino]acetic acid
CID 119171385
N-(2-hydroxyethyl)-2-(2-oxoazepan-1-yl)acetamide
CID 43388932
1,3-bis[(2-oxoazonan-1-yl)methyl]urea
CID 23348617
1-[2-[2-(methylaminomethyl)pyrrolidin-1-yl]-2-oxoethyl]piperidin-2-one;hydrochloride
CID 119651125
1-(7-butylsulfanyl-5-oxoheptyl)azepan-2-one
CID 54413049

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide?
The IUPAC name of N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide (CID 167682160) is N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide.
What is the SMILES notation for N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide?
The canonical SMILES for N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide is CNC(=O)CCCCC(=O)CN1CCCCC1=O.
What is the InChIKey of N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide?
The InChIKey is VRUSMTNGESCMBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O3/c1-14-12(17)7-3-2-6-11(16)10-15-9-5-4-8-13(15)18/h2-10H2,1H3,(H,14,17).
What are the key properties of N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide?
N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide has a molecular weight of 254.33 g/mol, XLogP of 0.87, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-oxo-7-(2-oxopiperidin-1-yl)heptanamide is sourced from PubChem (CID 167682160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).