2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide

C14H14ClN3O2 — CID 114937337

IUPAC2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide
SMILESCOc1ccc(C(Nc2cccc(Cl)c2)C(N)=O)cn1
InChIInChI=1S/C14H14ClN3O2/c1-20-12-6-5-9(8-17-12)13(14(16)19)18-11-4-2-3-10(15)7-11/h2-8,13,18H,1H3,(H2,16,19)
InChIKeyUAAFHQSRXBDZPG-UHFFFAOYSA-N
MW291.74 g/mol
LogP2.38
Rot. Bonds5

About 2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide

2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide (PubChem CID 114937337) has the molecular formula C14H14ClN3O2 and a molecular weight of 291.74 g/mol. Its IUPAC name is 2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide
PubChem CID114937337
Molecular FormulaC14H14ClN3O2
Molecular Weight291.74 g/mol
Exact Mass291.08
IUPAC Name2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide
SMILESCOc1ccc(C(Nc2cccc(Cl)c2)C(N)=O)cn1
InChIInChI=1S/C14H14ClN3O2/c1-20-12-6-5-9(8-17-12)13(14(16)19)18-11-4-2-3-10(15)7-11/h2-8,13,18H,1H3,(H2,16,19)
InChIKeyUAAFHQSRXBDZPG-UHFFFAOYSA-N
XLogP2.38
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide
CID 114937350
2-(3-chloroanilino)-2-(3-chloro-4-methoxyphenyl)acetamide
CID 65027018
2-(3-chloroanilino)-2-(3,4-dichlorophenyl)acetamide
CID 61005060
2-(2-fluoroanilino)-2-(6-methoxy-3-pyridinyl)acetamide
CID 114937351
2-(3,4-dichlorophenyl)-2-(3-methoxyanilino)acetamide
CID 60995627
2-(3-chloroanilino)-2-(4-methoxyphenyl)acetic acid
CID 60990738
2-(3-ethoxycarbonylanilino)-2-(6-methoxy-3-pyridinyl)acetic acid
CID 58556988
2-(3-chloroanilino)-2-(2,6-dichlorophenyl)acetamide
CID 61006415
2-(cyclohexylamino)-2-(6-methoxy-3-pyridinyl)acetamide
CID 114937363
1-(6-fluoro-1H-indol-3-yl)-2-(3-methoxyanilino)-2-(6-methoxy-3-pyridinyl)ethanone
CID 86728843
2-(3-bromoanilino)-2-(4-chlorophenyl)acetamide
CID 54891742
(2R)-2-(3-chloroanilino)propanamide;hydrochloride
CID 164755970

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide?
The IUPAC name of 2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide (CID 114937337) is 2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide?
The canonical SMILES for 2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide is COc1ccc(C(Nc2cccc(Cl)c2)C(N)=O)cn1.
What is the InChIKey of 2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide?
The InChIKey is UAAFHQSRXBDZPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O2/c1-20-12-6-5-9(8-17-12)13(14(16)19)18-11-4-2-3-10(15)7-11/h2-8,13,18H,1H3,(H2,16,19).
What are the key properties of 2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide?
2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide has a molecular weight of 291.74 g/mol, XLogP of 2.38, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloroanilino)-2-(6-methoxy-3-pyridinyl)acetamide is sourced from PubChem (CID 114937337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).