2-methylpropane;5-methylpyridine-3-carboxamide

C11H18N2O — CID 165136425

IUPAC2-methylpropane;5-methylpyridine-3-carboxamide
SMILESCC(C)C.Cc1cncc(C(N)=O)c1
InChIInChI=1S/C7H8N2O.C4H10/c1-5-2-6(7(8)10)4-9-3-5;1-4(2)3/h2-4H,1H3,(H2,8,10);4H,1-3H3
InChIKeyOPDCBHQTXYAOCR-UHFFFAOYSA-N
MW194.28 g/mol
LogP2.15
Rot. Bonds1

About 2-methylpropane;5-methylpyridine-3-carboxamide

2-methylpropane;5-methylpyridine-3-carboxamide (PubChem CID 165136425) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-methylpropane;5-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-methylpropane;5-methylpyridine-3-carboxamide
PubChem CID165136425
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name2-methylpropane;5-methylpyridine-3-carboxamide
SMILESCC(C)C.Cc1cncc(C(N)=O)c1
InChIInChI=1S/C7H8N2O.C4H10/c1-5-2-6(7(8)10)4-9-3-5;1-4(2)3/h2-4H,1H3,(H2,8,10);4H,1-3H3
InChIKeyOPDCBHQTXYAOCR-UHFFFAOYSA-N
XLogP2.15
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-amino-5-methylpyridine-3-carboximidamide
CID 77072547
5-methylpyridine-3-carbothioamide
CID 82667995
3-amino-4-methyl-1-(5-methyl-3-pyridinyl)pentan-1-one
CID 116606321
5-tert-butylpyridine-3-carboxamide
CID 59788901
3-methylbenzamide;2-methylpropane
CID 160767336
2-methoxy-3-methyl-1-(5-methyl-3-pyridinyl)butan-1-one
CID 116708503
(5-methyl-3-pyridinyl)-(4-propan-2-ylphenyl)methanone
CID 113297046
2-(aminomethyl)-2-methyl-1-(5-methyl-3-pyridinyl)butan-1-one
CID 116610906
2-ethyl-2-hydroxy-1-(5-methyl-3-pyridinyl)butan-1-one
CID 103446963
(5-methyl-3-pyridinyl)-(4-propan-2-ylcyclohexyl)methanone
CID 115374008
N-but-3-yn-2-yl-5-methylpyridine-3-carboxamide
CID 114390011
N-(3-amino-3-hydroxyimino-2-methylpropyl)-N,5-dimethylpyridine-3-carboxamide
CID 77072776

Frequently Asked Questions

What is the IUPAC name of 2-methylpropane;5-methylpyridine-3-carboxamide?
The IUPAC name of 2-methylpropane;5-methylpyridine-3-carboxamide (CID 165136425) is 2-methylpropane;5-methylpyridine-3-carboxamide.
What is the SMILES notation for 2-methylpropane;5-methylpyridine-3-carboxamide?
The canonical SMILES for 2-methylpropane;5-methylpyridine-3-carboxamide is CC(C)C.Cc1cncc(C(N)=O)c1.
What is the InChIKey of 2-methylpropane;5-methylpyridine-3-carboxamide?
The InChIKey is OPDCBHQTXYAOCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O.C4H10/c1-5-2-6(7(8)10)4-9-3-5;1-4(2)3/h2-4H,1H3,(H2,8,10);4H,1-3H3.
What are the key properties of 2-methylpropane;5-methylpyridine-3-carboxamide?
2-methylpropane;5-methylpyridine-3-carboxamide has a molecular weight of 194.28 g/mol, XLogP of 2.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropane;5-methylpyridine-3-carboxamide is sourced from PubChem (CID 165136425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).