ethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen

C12H22N2O — CID 171564740

IUPACethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen
SMILESCC.Cc1ccc(C(=O)NC(C)C)nc1.[H][H]
InChIInChI=1S/C10H14N2O.C2H6.H2/c1-7(2)12-10(13)9-5-4-8(3)6-11-9;1-2;/h4-7H,1-3H3,(H,12,13);1-2H3;1H
InChIKeyWCCKSBTUVUEACX-UHFFFAOYSA-N
MW210.32 g/mol
LogP2.80
Rot. Bonds2

About ethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen

ethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen (PubChem CID 171564740) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is ethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen.

Molecular Properties

Compound Nameethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen
PubChem CID171564740
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Nameethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen
SMILESCC.Cc1ccc(C(=O)NC(C)C)nc1.[H][H]
InChIInChI=1S/C10H14N2O.C2H6.H2/c1-7(2)12-10(13)9-5-4-8(3)6-11-9;1-2;/h4-7H,1-3H3,(H,12,13);1-2H3;1H
InChIKeyWCCKSBTUVUEACX-UHFFFAOYSA-N
XLogP2.80
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-propan-2-ylpyridine-2-carboxamide
CID 26370111
2-(methylamino)-1-(5-methyl-2-pyridinyl)propan-1-one;dihydrochloride
CID 155973448
N-cyclobutyl-5-methylpyridine-2-carboxamide
CID 170056265
5-(3-methylpentan-3-yl)-N-propan-2-ylpyridine-2-carboxamide
CID 176964984
5-(cyclohexylamino)-N-propan-2-ylpyridine-2-carboxamide
CID 109179444
5-bromo-N-[1-(4-methylphenyl)ethyl]pyridine-2-carboxamide
CID 62954039
carbon dioxide;methyl 5-methylpyridine-2-carboxylate
CID 157165111
ethane;N-propan-2-ylpyrazine-2-carboxamide
CID 143147775
2-N-(4-methylphenyl)-4-N-propan-2-ylpyridine-2,4-dicarboxamide
CID 109078101
N-propan-2-yl-5-[4-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 109179578
2-N,4-N-di(propan-2-yl)pyridine-2,4-dicarboxamide
CID 109078008
5-[butyl(methyl)amino]-N-propan-2-ylpyridine-2-carboxamide
CID 109179517

Frequently Asked Questions

What is the IUPAC name of ethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen?
The IUPAC name of ethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen (CID 171564740) is ethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen.
What is the SMILES notation for ethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen?
The canonical SMILES for ethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen is CC.Cc1ccc(C(=O)NC(C)C)nc1.[H][H].
What is the InChIKey of ethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen?
The InChIKey is WCCKSBTUVUEACX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O.C2H6.H2/c1-7(2)12-10(13)9-5-4-8(3)6-11-9;1-2;/h4-7H,1-3H3,(H,12,13);1-2H3;1H.
What are the key properties of ethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen?
ethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen has a molecular weight of 210.32 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methyl-N-propan-2-ylpyridine-2-carboxamide;molecular hydrogen is sourced from PubChem (CID 171564740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).