N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide

C18H19N3O2 — CID 56784483

IUPACN-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide
SMILESCc1ccccc1CC(=O)Nc1ccc(NC(=O)C2CC2)nc1
InChIInChI=1S/C18H19N3O2/c1-12-4-2-3-5-14(12)10-17(22)20-15-8-9-16(19-11-15)21-18(23)13-6-7-13/h2-5,8-9,11,13H,6-7,10H2,1H3,(H,20,22)(H,19,21,23)
InChIKeyANLFOAGBZSNXIS-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.92
Rot. Bonds5

About N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide

N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide (PubChem CID 56784483) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide
PubChem CID56784483
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide
SMILESCc1ccccc1CC(=O)Nc1ccc(NC(=O)C2CC2)nc1
InChIInChI=1S/C18H19N3O2/c1-12-4-2-3-5-14(12)10-17(22)20-15-8-9-16(19-11-15)21-18(23)13-6-7-13/h2-5,8-9,11,13H,6-7,10H2,1H3,(H,20,22)(H,19,21,23)
InChIKeyANLFOAGBZSNXIS-UHFFFAOYSA-N
XLogP2.92
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]cyclopropanecarboxamide
CID 113011542
N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]cyclobutanecarboxamide
CID 113026538
N-[5-(cyclopropylamino)-2-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113023745
N-[6-(tert-butylamino)-3-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113014815
N-[5-(2-methylanilino)-2-pyridinyl]-2-(2-methylphenyl)acetamide
CID 113031347
N-[5-[(2-methylphenyl)methylamino]-2-pyridinyl]propanamide
CID 113026477
N-[5-(3-aminopropanoylamino)-2-pyridinyl]cyclopropanecarboxamide
CID 119879406
N-[5-[3-(2-aminophenyl)propanoylamino]-2-pyridinyl]cyclopropanecarboxamide
CID 120613024
N-[6-(2-methylanilino)-3-pyridinyl]cyclopropanecarboxamide
CID 113016079
2-(2-methylphenyl)-N-[5-(2-methylpropylamino)-2-pyridinyl]acetamide
CID 113024145
N-[5-[(2-chlorophenyl)methylamino]-2-pyridinyl]cyclopropanecarboxamide
CID 113027169
N-[5-[[(2R)-2-(2-methylphenoxy)butanoyl]amino]-2-pyridinyl]cyclopropanecarboxamide
CID 97319750

Frequently Asked Questions

What is the IUPAC name of N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide?
The IUPAC name of N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide (CID 56784483) is N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide?
The canonical SMILES for N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide is Cc1ccccc1CC(=O)Nc1ccc(NC(=O)C2CC2)nc1.
What is the InChIKey of N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide?
The InChIKey is ANLFOAGBZSNXIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-12-4-2-3-5-14(12)10-17(22)20-15-8-9-16(19-11-15)21-18(23)13-6-7-13/h2-5,8-9,11,13H,6-7,10H2,1H3,(H,20,22)(H,19,21,23).
What are the key properties of N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide?
N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide has a molecular weight of 309.37 g/mol, XLogP of 2.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[[2-(2-methylphenyl)acetyl]amino]-2-pyridinyl]cyclopropanecarboxamide is sourced from PubChem (CID 56784483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).