N-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide

C14H15N3O2 — CID 62880154

IUPACN-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide
SMILESCc1c(N)cccc1NC(=O)Cn1ccc(=O)cc1
InChIInChI=1S/C14H15N3O2/c1-10-12(15)3-2-4-13(10)16-14(19)9-17-7-5-11(18)6-8-17/h2-8H,9,15H2,1H3,(H,16,19)
InChIKeyWBQHGWFRJNSDER-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.38
Rot. Bonds3

About N-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide

N-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide (PubChem CID 62880154) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide
PubChem CID62880154
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide
SMILESCc1c(N)cccc1NC(=O)Cn1ccc(=O)cc1
InChIInChI=1S/C14H15N3O2/c1-10-12(15)3-2-4-13(10)16-14(19)9-17-7-5-11(18)6-8-17/h2-8H,9,15H2,1H3,(H,16,19)
InChIKeyWBQHGWFRJNSDER-UHFFFAOYSA-N
XLogP1.38
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.38
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

N-(3-amino-2-methylphenyl)-2-(6-oxopyridazin-1-yl)acetamide
CID 62851005
N-(3-amino-2-methylphenyl)-2-(1,3-dihydroisoindol-2-yl)acetamide
CID 62206392
N-(3-amino-2-methylphenyl)-2-indol-1-ylacetamide
CID 43247265
N-(3-amino-2-methylphenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide
CID 55078174
N-(3-amino-2-methylphenyl)-2-(4,5-dimethyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 63312237
N-(3-amino-2-methylphenyl)-2-(2-ethylimidazol-1-yl)acetamide
CID 61402207
N-(3-amino-2-methylphenyl)-2-(2-propan-2-ylimidazol-1-yl)acetamide
CID 43198911
N-(3-amino-2-methylphenyl)-2-(4-methyl-3-oxo-1,4-diazepan-1-yl)acetamide
CID 102888500
N-(3-amino-2-methylphenyl)-2-(4-propan-2-ylpiperidin-1-yl)acetamide
CID 103505272
(3-amino-2-methylphenyl)urea
CID 16770559
N-(3-amino-2-methylphenyl)-3-(dimethylamino)propanamide
CID 16792974
methyl 2-[2-(3-amino-2-methylanilino)-2-oxoethyl]sulfanylacetate
CID 43618012

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide (CID 62880154) is N-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide is Cc1c(N)cccc1NC(=O)Cn1ccc(=O)cc1.
What is the InChIKey of N-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide?
The InChIKey is WBQHGWFRJNSDER-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-10-12(15)3-2-4-13(10)16-14(19)9-17-7-5-11(18)6-8-17/h2-8H,9,15H2,1H3,(H,16,19).
What are the key properties of N-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide?
N-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide has a molecular weight of 257.29 g/mol, XLogP of 1.38, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-methylphenyl)-2-(4-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 62880154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).