N-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide

C14H12ClN3O2 — CID 170189596

IUPACN-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide
SMILESCC(=O)N(c1ccc(C)c(Cl)c1)c1cc(N=O)ccn1
InChIInChI=1S/C14H12ClN3O2/c1-9-3-4-12(8-13(9)15)18(10(2)19)14-7-11(17-20)5-6-16-14/h3-8H,1-2H3
InChIKeyIZYJTIFVPQDUHH-UHFFFAOYSA-N
MW289.72 g/mol
LogP4.13
Rot. Bonds3

About N-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide

N-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide (PubChem CID 170189596) has the molecular formula C14H12ClN3O2 and a molecular weight of 289.72 g/mol. Its IUPAC name is N-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide
PubChem CID170189596
Molecular FormulaC14H12ClN3O2
Molecular Weight289.72 g/mol
Exact Mass289.06
IUPAC NameN-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide
SMILESCC(=O)N(c1ccc(C)c(Cl)c1)c1cc(N=O)ccn1
InChIInChI=1S/C14H12ClN3O2/c1-9-3-4-12(8-13(9)15)18(10(2)19)14-7-11(17-20)5-6-16-14/h3-8H,1-2H3
InChIKeyIZYJTIFVPQDUHH-UHFFFAOYSA-N
XLogP4.13
TPSA62.63 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.72
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chloro-4-methylphenyl)-N-[4-(oxidoamino)-2-pyridinyl]acetamide
CID 169022993
N-(3-fluorophenyl)-N-(4-nitroso-2-pyridinyl)acetamide
CID 169022978
N-[2-(N-acetyl-3,4-difluoroanilino)-4-pyridinyl]-2-(2-chloro-4,6-dimethylphenyl)acetamide
CID 162428331
N-(3-chlorophenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide
CID 166927724
N-(3-chlorophenyl)-N-[4-(oxidoamino)-2-pyridinyl]acetamide
CID 169022950
3-chloro-N,N,4-trimethylaniline
CID 12637287
2-methyl-4-nitrosopyridine
CID 88648180
N-isoquinolin-6-yl-N-[4-(methylamino)-2-pyridinyl]acetamide
CID 162746574
N-(4-amino-2-pyridinyl)-N-(3-fluoro-4-methoxyphenyl)acetamide
CID 162428454
3-(N-acetyl-3-chloro-4-methylanilino)-2-methylpropanoic acid
CID 82320541
4-[(3-chloro-4-methylphenyl)carbamoylamino]pyridine-2-carboxylic acid
CID 63651885
N-(4-fluoro-3-methoxyphenyl)-N-[4-(hydroxyamino)-2-pyridinyl]acetamide
CID 170189482

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide?
The IUPAC name of N-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide (CID 170189596) is N-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide.
What is the SMILES notation for N-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide?
The canonical SMILES for N-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide is CC(=O)N(c1ccc(C)c(Cl)c1)c1cc(N=O)ccn1.
What is the InChIKey of N-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide?
The InChIKey is IZYJTIFVPQDUHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3O2/c1-9-3-4-12(8-13(9)15)18(10(2)19)14-7-11(17-20)5-6-16-14/h3-8H,1-2H3.
What are the key properties of N-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide?
N-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide has a molecular weight of 289.72 g/mol, XLogP of 4.13, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methylphenyl)-N-(4-nitroso-2-pyridinyl)acetamide is sourced from PubChem (CID 170189596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).