N-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide

C16H16ClN3O2 — CID 71971049

IUPACN-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide
SMILESO=C(Cn1ccccc1=O)Nc1cc(Cl)ccc1NC1CC1
InChIInChI=1S/C16H16ClN3O2/c17-11-4-7-13(18-12-5-6-12)14(9-11)19-15(21)10-20-8-2-1-3-16(20)22/h1-4,7-9,12,18H,5-6,10H2,(H,19,21)
InChIKeyBBNLDSUANFCVHL-UHFFFAOYSA-N
MW317.78 g/mol
LogP2.71
Rot. Bonds5

About N-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide

N-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide (PubChem CID 71971049) has the molecular formula C16H16ClN3O2 and a molecular weight of 317.78 g/mol. Its IUPAC name is N-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide.

Molecular Properties

Compound NameN-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide
PubChem CID71971049
Molecular FormulaC16H16ClN3O2
Molecular Weight317.78 g/mol
Exact Mass317.09
IUPAC NameN-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide
SMILESO=C(Cn1ccccc1=O)Nc1cc(Cl)ccc1NC1CC1
InChIInChI=1S/C16H16ClN3O2/c17-11-4-7-13(18-12-5-6-12)14(9-11)19-15(21)10-20-8-2-1-3-16(20)22/h1-4,7-9,12,18H,5-6,10H2,(H,19,21)
InChIKeyBBNLDSUANFCVHL-UHFFFAOYSA-N
XLogP2.71
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.78
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-[5-chloro-2-(cyclopropylamino)phenyl]propanamide
CID 119856759
N-(2-amino-5-chlorophenyl)-3-(2-oxo-1-pyridinyl)propanamide
CID 16786560
4-amino-N-[5-chloro-2-(cyclopropylamino)phenyl]-3-methoxybutanamide
CID 120595674
N-[(4-chlorophenyl)methyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 27686969
N-[1-(2,4-dichlorophenyl)ethyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 51175104
3-(7-bromo-3-oxo-1H-isoindol-2-yl)-N-[5-chloro-2-(cyclopropylamino)phenyl]propanamide
CID 67516500
N-(4,5-dimethoxy-2-methylphenyl)-2-(2-oxo-1-pyridinyl)acetamide
CID 51176075
N-(2-amino-4-chlorophenyl)-2-(3-methyl-2-oxo-1-pyridinyl)acetamide
CID 63172766
N-(2,5-dichlorophenyl)-2-pyrrol-1-ylacetamide
CID 110688644
N-(2,5-dichlorophenyl)-2-(2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 84571692
N-[4-methyl-3-(methylsulfamoyl)phenyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 24646802
N-(2-amino-5-chlorophenyl)-2-(4-methyl-2-oxo-1-pyridinyl)acetamide
CID 62962839

Frequently Asked Questions

What is the IUPAC name of N-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide?
The IUPAC name of N-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide (CID 71971049) is N-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide.
What is the SMILES notation for N-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide?
The canonical SMILES for N-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide is O=C(Cn1ccccc1=O)Nc1cc(Cl)ccc1NC1CC1.
What is the InChIKey of N-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide?
The InChIKey is BBNLDSUANFCVHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClN3O2/c17-11-4-7-13(18-12-5-6-12)14(9-11)19-15(21)10-20-8-2-1-3-16(20)22/h1-4,7-9,12,18H,5-6,10H2,(H,19,21).
What are the key properties of N-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide?
N-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide has a molecular weight of 317.78 g/mol, XLogP of 2.71, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-chloro-2-(cyclopropylamino)phenyl]-2-(2-oxo-1-pyridinyl)acetamide is sourced from PubChem (CID 71971049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).