2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide

C14H13IN2O2 — CID 47110693

IUPAC2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide
SMILESCc1cccnc1NC(=O)COc1ccc(I)cc1
InChIInChI=1S/C14H13IN2O2/c1-10-3-2-8-16-14(10)17-13(18)9-19-12-6-4-11(15)5-7-12/h2-8H,9H2,1H3,(H,16,17,18)
InChIKeyNRFXOKXLBZQSHH-UHFFFAOYSA-N
MW368.17 g/mol
LogP3.01
Rot. Bonds4

About 2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide

2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide (PubChem CID 47110693) has the molecular formula C14H13IN2O2 and a molecular weight of 368.17 g/mol. Its IUPAC name is 2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide
PubChem CID47110693
Molecular FormulaC14H13IN2O2
Molecular Weight368.17 g/mol
Exact Mass368.00
IUPAC Name2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide
SMILESCc1cccnc1NC(=O)COc1ccc(I)cc1
InChIInChI=1S/C14H13IN2O2/c1-10-3-2-8-16-14(10)17-13(18)9-19-12-6-4-11(15)5-7-12/h2-8H,9H2,1H3,(H,16,17,18)
InChIKeyNRFXOKXLBZQSHH-UHFFFAOYSA-N
XLogP3.01
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.17
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(3-methyl-4-propan-2-ylphenoxy)-N-(3-methyl-2-pyridinyl)acetamide
CID 27896918
2-(4-chloro-3-methylphenoxy)-N-(3-hydroxy-2-pyridinyl)acetamide
CID 18109443
2-(4-chlorophenoxy)-N-[3-[(2-methylphenyl)methoxy]-2-pyridinyl]acetamide
CID 84559835
2-(4-iodophenoxy)-N-(2-propan-2-ylpyrazol-3-yl)acetamide
CID 47097263
4-[(3-methyl-2-pyridinyl)amino]-4-oxobutanoic acid
CID 810222
N-(3-methyl-2-pyridinyl)-4-(4-methylsulfonylphenoxy)butanamide
CID 51096727
2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide
CID 17173876
N-(4-amino-2-methylphenyl)-2-(4-iodophenoxy)acetamide
CID 43144731
2-[4-[[2-(4-iodophenoxy)acetyl]amino]-3-methylphenoxy]acetic acid
CID 17342102
2-(2-hydroxyphenyl)-N-(3-methyl-2-pyridinyl)acetamide
CID 60615989
2-anilino-N-(3-methyl-2-pyridinyl)acetamide
CID 60860277
2-[4-[(2S)-butan-2-yl]phenoxy]-N-(5-iodo-3-methyl-2-pyridinyl)acetamide
CID 39378744

Frequently Asked Questions

What is the IUPAC name of 2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide?
The IUPAC name of 2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide (CID 47110693) is 2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide.
What is the SMILES notation for 2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide?
The canonical SMILES for 2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide is Cc1cccnc1NC(=O)COc1ccc(I)cc1.
What is the InChIKey of 2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide?
The InChIKey is NRFXOKXLBZQSHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13IN2O2/c1-10-3-2-8-16-14(10)17-13(18)9-19-12-6-4-11(15)5-7-12/h2-8H,9H2,1H3,(H,16,17,18).
What are the key properties of 2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide?
2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide has a molecular weight of 368.17 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-iodophenoxy)-N-(3-methyl-2-pyridinyl)acetamide is sourced from PubChem (CID 47110693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).