ethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide

C12H18N2O — CID 144888872

IUPACethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide
SMILESCC.Cc1cncc(NC(=O)C2CC2)c1
InChIInChI=1S/C10H12N2O.C2H6/c1-7-4-9(6-11-5-7)12-10(13)8-2-3-8;1-2/h4-6,8H,2-3H2,1H3,(H,12,13);1-2H3
InChIKeyLQYHKKUFNZJKPR-UHFFFAOYSA-N
MW206.29 g/mol
LogP2.76
Rot. Bonds2

About ethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide

ethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide (PubChem CID 144888872) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is ethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide.

Molecular Properties

Compound Nameethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide
PubChem CID144888872
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Nameethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide
SMILESCC.Cc1cncc(NC(=O)C2CC2)c1
InChIInChI=1S/C10H12N2O.C2H6/c1-7-4-9(6-11-5-7)12-10(13)8-2-3-8;1-2/h4-6,8H,2-3H2,1H3,(H,12,13);1-2H3
InChIKeyLQYHKKUFNZJKPR-UHFFFAOYSA-N
XLogP2.76
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-[(5-methyl-3-pyridinyl)carbamoyl]oxolane-2-carboxylic acid
CID 107584585
N-(5-methyl-3-pyridinyl)piperidine-2-carboxamide
CID 103814497
(2S)-N-(5-methyl-3-pyridinyl)pyrrolidine-2-carboxamide;dihydrochloride
CID 119884720
N-(5-methyl-3-pyridinyl)-7-azabicyclo[2.2.1]heptane-2-carboxamide
CID 103814554
N-(3-fluoro-5-methylphenyl)cyclopropanecarboxamide
CID 79047928
2-(2-methylpiperidin-1-yl)-N-(5-methyl-3-pyridinyl)-2-oxoacetamide
CID 177382926
4-(pyrimidin-5-ylcarbamoyl)cyclohexane-1-carboxylic acid
CID 107589551
N-(6-methylpyrazin-2-yl)cyclopropanecarboxamide
CID 118258313
4-N-(3,5-dimethylphenyl)-1-N-(3-methylphenyl)cyclohexane-1,4-dicarboxamide
CID 109150418
1-N-(3,5-dimethylphenyl)-4-N-(5-methyl-1,2-oxazol-3-yl)cyclohexane-1,4-dicarboxamide
CID 109150712
1-(5-methyl-3-pyridinyl)-3-phenylurea
CID 110748489
2-chloro-N-(5-methyl-3-pyridinyl)propanamide
CID 103881690

Frequently Asked Questions

What is the IUPAC name of ethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide?
The IUPAC name of ethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide (CID 144888872) is ethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide.
What is the SMILES notation for ethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide?
The canonical SMILES for ethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide is CC.Cc1cncc(NC(=O)C2CC2)c1.
What is the InChIKey of ethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide?
The InChIKey is LQYHKKUFNZJKPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O.C2H6/c1-7-4-9(6-11-5-7)12-10(13)8-2-3-8;1-2/h4-6,8H,2-3H2,1H3,(H,12,13);1-2H3.
What are the key properties of ethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide?
ethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide has a molecular weight of 206.29 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-(5-methyl-3-pyridinyl)cyclopropanecarboxamide is sourced from PubChem (CID 144888872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).