2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide

C9H11ClN2O — CID 4199160

IUPAC2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide
SMILESCc1cc(C)nc(NC(=O)CCl)c1
InChIInChI=1S/C9H11ClN2O/c1-6-3-7(2)11-8(4-6)12-9(13)5-10/h3-4H,5H2,1-2H3,(H,11,12,13)
InChIKeyVNVYARLTTTVRGE-UHFFFAOYSA-N
MW198.65 g/mol
LogP1.88
Rot. Bonds2

About 2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide

2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide (PubChem CID 4199160) has the molecular formula C9H11ClN2O and a molecular weight of 198.65 g/mol. Its IUPAC name is 2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide
PubChem CID4199160
Molecular FormulaC9H11ClN2O
Molecular Weight198.65 g/mol
Exact Mass198.06
IUPAC Name2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide
SMILESCc1cc(C)nc(NC(=O)CCl)c1
InChIInChI=1S/C9H11ClN2O/c1-6-3-7(2)11-8(4-6)12-9(13)5-10/h3-4H,5H2,1-2H3,(H,11,12,13)
InChIKeyVNVYARLTTTVRGE-UHFFFAOYSA-N
XLogP1.88
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.65
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

N-(4,6-dimethyl-2-pyridinyl)-2-(4-methylphenyl)acetamide
CID 17148768
CID 10084917
CID 10084917
N-(4,6-dimethyl-2-pyridinyl)hexanamide
CID 5075598
N-(4,6-dimethyl-2-pyridinyl)nonanamide
CID 4047413
2,6-dichloro-N-(4,6-dimethyl-2-pyridinyl)benzamide
CID 5099860
2-(butan-2-ylamino)-N-(4,6-dimethyl-2-pyridinyl)acetamide
CID 114932408
4-[(4,6-dimethyl-2-pyridinyl)amino]-2,2-diethyl-4-oxobutanoic acid
CID 114931869
6-amino-N-(4,6-dimethyl-2-pyridinyl)pyrazine-2-carboxamide
CID 114036111
2-(cyclopropylmethoxy)-N-(4,6-dimethyl-2-pyridinyl)acetamide
CID 136516820
6-amino-N-(4,6-dimethyl-2-pyridinyl)-4-methylhexanamide
CID 114932264
N-(4,6-dimethyl-2-pyridinyl)-6-(propylamino)pyridine-2-carboxamide
CID 114933112
N-(4,6-dimethyl-2-pyridinyl)-3-pyrrol-1-ylbutanamide
CID 174332471

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide?
The IUPAC name of 2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide (CID 4199160) is 2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide is Cc1cc(C)nc(NC(=O)CCl)c1.
What is the InChIKey of 2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide?
The InChIKey is VNVYARLTTTVRGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2O/c1-6-3-7(2)11-8(4-6)12-9(13)5-10/h3-4H,5H2,1-2H3,(H,11,12,13).
What are the key properties of 2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide?
2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide has a molecular weight of 198.65 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(4,6-dimethyl-2-pyridinyl)acetamide is sourced from PubChem (CID 4199160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).