2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide

C15H21N3O2 — CID 51098301

IUPAC2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide
SMILESCN(C(=O)c1ccc(C(N)=O)cn1)C1CCCCCC1
InChIInChI=1S/C15H21N3O2/c1-18(12-6-4-2-3-5-7-12)15(20)13-9-8-11(10-17-13)14(16)19/h8-10,12H,2-7H2,1H3,(H2,16,19)
InChIKeyPMJGXCRGORJVPC-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.98
Rot. Bonds3

About 2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide

2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide (PubChem CID 51098301) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide.

Molecular Properties

Compound Name2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide
PubChem CID51098301
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide
SMILESCN(C(=O)c1ccc(C(N)=O)cn1)C1CCCCCC1
InChIInChI=1S/C15H21N3O2/c1-18(12-6-4-2-3-5-7-12)15(20)13-9-8-11(10-17-13)14(16)19/h8-10,12H,2-7H2,1H3,(H2,16,19)
InChIKeyPMJGXCRGORJVPC-UHFFFAOYSA-N
XLogP1.98
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-5-(N'-hydroxycarbamimidoyl)-N-methylpyridine-2-carboxamide
CID 77005127
5-(N'-hydroxycarbamimidoyl)-N-methyl-N-(4-methylcyclohexyl)pyridine-2-carboxamide
CID 77005098
5-N-(1,1-dioxothiolan-3-yl)-5-N-methylpyridine-2,5-dicarboxamide
CID 47460685
N-cyclobutyl-N-methylpyridine-2-carboxamide
CID 126857014
5-[methyl-(4-methylcyclohexyl)carbamoyl]pyridine-2-carboxylic acid
CID 60725247
N-(4-aminocyclohexyl)-5-bromo-N-methylpyridine-2-carboxamide
CID 79121873
5-amino-N-methyl-N-(1-methylpiperidin-4-yl)pyridine-2-carboxamide
CID 81318919
N-(4-aminocyclohexyl)-5-fluoro-N-methylpyridine-2-carboxamide
CID 104637892
N-cyclohexyl-4-hydroxy-N-methylbenzamide
CID 43176625
6-[methyl-(2-phenylcyclohexyl)carbamoyl]pyridine-3-carboxylic acid
CID 136556641
N-(azepan-4-yl)-5-fluoro-N-methylpyridine-2-carboxamide
CID 107172496
N-cyclohexyl-4-iodo-N-methylbenzamide
CID 30383969

Frequently Asked Questions

What is the IUPAC name of 2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide?
The IUPAC name of 2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide (CID 51098301) is 2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide.
What is the SMILES notation for 2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide?
The canonical SMILES for 2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide is CN(C(=O)c1ccc(C(N)=O)cn1)C1CCCCCC1.
What is the InChIKey of 2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide?
The InChIKey is PMJGXCRGORJVPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-18(12-6-4-2-3-5-7-12)15(20)13-9-8-11(10-17-13)14(16)19/h8-10,12H,2-7H2,1H3,(H2,16,19).
What are the key properties of 2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide?
2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide has a molecular weight of 275.35 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cycloheptyl-2-N-methylpyridine-2,5-dicarboxamide is sourced from PubChem (CID 51098301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).