N-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide

C10H13ClN2O — CID 13154248

IUPACN-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1cccc(Cl)n1
InChIInChI=1S/C10H13ClN2O/c1-10(2,3)9(14)13-8-6-4-5-7(11)12-8/h4-6H,1-3H3,(H,12,13,14)
InChIKeyYPWKLBCTOUEZKE-UHFFFAOYSA-N
MW212.68 g/mol
LogP2.72
Rot. Bonds1

About N-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide

N-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide (PubChem CID 13154248) has the molecular formula C10H13ClN2O and a molecular weight of 212.68 g/mol. Its IUPAC name is N-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide
PubChem CID13154248
Molecular FormulaC10H13ClN2O
Molecular Weight212.68 g/mol
Exact Mass212.07
IUPAC NameN-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)Nc1cccc(Cl)n1
InChIInChI=1S/C10H13ClN2O/c1-10(2,3)9(14)13-8-6-4-5-7(11)12-8/h4-6H,1-3H3,(H,12,13,14)
InChIKeyYPWKLBCTOUEZKE-UHFFFAOYSA-N
XLogP2.72
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.68
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N,N'-2,6-Pyridinediylbisacetamide
CID 95139
2-Acetamido-5-chloropyridine
CID 798653
2-(Pivaloylamino)pyridine
CID 1051519
N-(5-chloropyridin-2-yl)-2-methylpentanamide
CID 2889757
N-(5-chloropyridin-2-yl)cyclopropanecarboxamide
CID 686089
2-Acetamido-6-methylpyridine
CID 220486
1-(4-Chlorophenyl)-3-(6-methylpyridin-2-yl)urea
CID 836687
N-(5-Chloro-2-pyridinyl)-3-oxobutanamide
CID 811631
N-{6-[(cyclopropylcarbonyl)amino]-2-pyridinyl}cyclopropanecarboxamide
CID 1226004
N-(6-acetamidopyridin-2-yl)prop-2-enamide
CID 86071301
2-chloro-N-(5-chloropyridin-2-yl)acetamide
CID 5151148
N-(5-chloropyridin-2-yl)-2-ethylhexanamide
CID 645923

Frequently Asked Questions

What is the IUPAC name of N-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide (CID 13154248) is N-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide is CC(C)(C)C(=O)Nc1cccc(Cl)n1.
What is the InChIKey of N-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide?
The InChIKey is YPWKLBCTOUEZKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2O/c1-10(2,3)9(14)13-8-6-4-5-7(11)12-8/h4-6H,1-3H3,(H,12,13,14).
What are the key properties of N-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide?
N-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide has a molecular weight of 212.68 g/mol, XLogP of 2.72, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloro-2-pyridinyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 13154248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).