2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide

C14H14ClN3O2 — CID 103093864

IUPAC2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide
SMILESCCOc1cccc(N)c1C(=O)Nc1ncccc1Cl
InChIInChI=1S/C14H14ClN3O2/c1-2-20-11-7-3-6-10(16)12(11)14(19)18-13-9(15)5-4-8-17-13/h3-8H,2,16H2,1H3,(H,17,18,19)
InChIKeySPHBZXUKTFCFJN-UHFFFAOYSA-N
MW291.74 g/mol
LogP2.97
Rot. Bonds4

About 2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide

2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide (PubChem CID 103093864) has the molecular formula C14H14ClN3O2 and a molecular weight of 291.74 g/mol. Its IUPAC name is 2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide.

Molecular Properties

Compound Name2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide
PubChem CID103093864
Molecular FormulaC14H14ClN3O2
Molecular Weight291.74 g/mol
Exact Mass291.08
IUPAC Name2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide
SMILESCCOc1cccc(N)c1C(=O)Nc1ncccc1Cl
InChIInChI=1S/C14H14ClN3O2/c1-2-20-11-7-3-6-10(16)12(11)14(19)18-13-9(15)5-4-8-17-13/h3-8H,2,16H2,1H3,(H,17,18,19)
InChIKeySPHBZXUKTFCFJN-UHFFFAOYSA-N
XLogP2.97
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.74
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(2-chloro-5-methylphenyl)-6-ethoxybenzamide
CID 107624071
2-amino-6-ethoxy-N-(2-methylpyrazol-3-yl)benzamide
CID 81420449
2-amino-6-ethoxy-N-(1,3-thiazol-2-yl)benzamide
CID 81409659
3-amino-N-(3-chloro-2-pyridinyl)pyridine-2-carboxamide
CID 103094260
2-amino-N-(4,6-dimethylpyrimidin-2-yl)-6-ethoxybenzamide
CID 81394291
2-amino-N-(3-chloro-2-pyridinyl)-3-methoxybenzamide
CID 103093876
2-amino-N-(2-bromo-5-chlorophenyl)-6-ethoxybenzamide
CID 81394707
2-amino-6-ethoxy-N-(3-fluoro-4-pyridinyl)benzamide
CID 107594556
2-amino-N-(2-bromophenyl)-6-ethoxybenzamide
CID 81410099
2-amino-N-(2-chloro-3-pyridinyl)-6-methoxybenzamide
CID 81421056
2-amino-6-ethoxy-N-(3-ethylpentan-3-yl)benzamide
CID 81420265
2-amino-N-(5-bromopyrazin-2-yl)-6-ethoxybenzamide
CID 81420199

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide?
The IUPAC name of 2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide (CID 103093864) is 2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide.
What is the SMILES notation for 2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide?
The canonical SMILES for 2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide is CCOc1cccc(N)c1C(=O)Nc1ncccc1Cl.
What is the InChIKey of 2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide?
The InChIKey is SPHBZXUKTFCFJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN3O2/c1-2-20-11-7-3-6-10(16)12(11)14(19)18-13-9(15)5-4-8-17-13/h3-8H,2,16H2,1H3,(H,17,18,19).
What are the key properties of 2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide?
2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide has a molecular weight of 291.74 g/mol, XLogP of 2.97, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3-chloro-2-pyridinyl)-6-ethoxybenzamide is sourced from PubChem (CID 103093864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).