N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide

C16H24N2O2 — CID 78990985

IUPACN-(6-oxopiperidin-3-yl)adamantane-2-carboxamide
SMILESO=C1CCC(NC(=O)C2C3CC4CC(C3)CC2C4)CN1
InChIInChI=1S/C16H24N2O2/c19-14-2-1-13(8-17-14)18-16(20)15-11-4-9-3-10(6-11)7-12(15)5-9/h9-13,15H,1-8H2,(H,17,19)(H,18,20)
InChIKeyVDLSWYNPKPGJNN-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.45
Rot. Bonds2

About N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide

N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide (PubChem CID 78990985) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide.

Molecular Properties

Compound NameN-(6-oxopiperidin-3-yl)adamantane-2-carboxamide
PubChem CID78990985
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-(6-oxopiperidin-3-yl)adamantane-2-carboxamide
SMILESO=C1CCC(NC(=O)C2C3CC4CC(C3)CC2C4)CN1
InChIInChI=1S/C16H24N2O2/c19-14-2-1-13(8-17-14)18-16(20)15-11-4-9-3-10(6-11)7-12(15)5-9/h9-13,15H,1-8H2,(H,17,19)(H,18,20)
InChIKeyVDLSWYNPKPGJNN-UHFFFAOYSA-N
XLogP1.45
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(6-oxopiperidin-3-yl)carbamic acid
CID 77299994
N-(6-oxopiperidin-3-yl)pyrrolidine-3-carboxamide
CID 63663368
N-(8-azabicyclo[3.2.1]octan-3-yl)adamantane-2-carboxamide
CID 81099772
N-(4-hydroxycyclohexyl)adamantane-2-carboxamide
CID 78914074
6-oxo-N-(5-oxopyrrolidin-3-yl)piperidine-3-carboxamide
CID 104580966
1,1-dimethyl-3-(6-oxopiperidin-3-yl)urea
CID 78916658
2,2,2-trifluoro-N-(6-oxopiperidin-3-yl)acetamide
CID 63374613
5-amino-2,4-dimethyl-N-(6-oxopiperidin-3-yl)cyclohexane-1-carboxamide
CID 102706749
5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide
CID 62896987
2,2-dimethyl-3-[(6-oxopiperidin-3-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 64836966
3-methyl-N-(6-oxopiperidin-3-yl)pyrrolidine-2-carboxamide
CID 102779455
N-(6-oxopiperidin-3-yl)pyridine-4-carboxamide
CID 62492175

Frequently Asked Questions

What is the IUPAC name of N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide?
The IUPAC name of N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide (CID 78990985) is N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide.
What is the SMILES notation for N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide?
The canonical SMILES for N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide is O=C1CCC(NC(=O)C2C3CC4CC(C3)CC2C4)CN1.
What is the InChIKey of N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide?
The InChIKey is VDLSWYNPKPGJNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c19-14-2-1-13(8-17-14)18-16(20)15-11-4-9-3-10(6-11)7-12(15)5-9/h9-13,15H,1-8H2,(H,17,19)(H,18,20).
What are the key properties of N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide?
N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-oxopiperidin-3-yl)adamantane-2-carboxamide is sourced from PubChem (CID 78990985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).