2-[(6-chloro-2-pyridinyl)amino]propanamide

C8H10ClN3O — CID 63587646

IUPAC2-[(6-chloro-2-pyridinyl)amino]propanamide
SMILESCC(Nc1cccc(Cl)n1)C(N)=O
InChIInChI=1S/C8H10ClN3O/c1-5(8(10)13)11-7-4-2-3-6(9)12-7/h2-5H,1H3,(H2,10,13)(H,11,12)
InChIKeyJFUYTHCBFWULTN-UHFFFAOYSA-N
MW199.64 g/mol
LogP1.02
Rot. Bonds3

About 2-[(6-chloro-2-pyridinyl)amino]propanamide

2-[(6-chloro-2-pyridinyl)amino]propanamide (PubChem CID 63587646) has the molecular formula C8H10ClN3O and a molecular weight of 199.64 g/mol. Its IUPAC name is 2-[(6-chloro-2-pyridinyl)amino]propanamide.

Molecular Properties

Compound Name2-[(6-chloro-2-pyridinyl)amino]propanamide
PubChem CID63587646
Molecular FormulaC8H10ClN3O
Molecular Weight199.64 g/mol
Exact Mass199.05
IUPAC Name2-[(6-chloro-2-pyridinyl)amino]propanamide
SMILESCC(Nc1cccc(Cl)n1)C(N)=O
InChIInChI=1S/C8H10ClN3O/c1-5(8(10)13)11-7-4-2-3-6(9)12-7/h2-5H,1H3,(H2,10,13)(H,11,12)
InChIKeyJFUYTHCBFWULTN-UHFFFAOYSA-N
XLogP1.02
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.64
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-[(6-amino-2-pyridinyl)amino]propanamide
CID 80647728
2-[(2-chloropyrimidin-4-yl)amino]propanamide
CID 62343252
2-[(6-chloro-4-cyano-2-pyridinyl)amino]propanamide
CID 83073416
6-chloro-N-[(2R)-1-methoxypropan-2-yl]pyridin-2-amine
CID 131065257
methyl 2-[[6-(propylamino)-2-pyridinyl]amino]propanoate
CID 80801764
2-[(6-bromo-2-pyridinyl)amino]-3-methylbutanamide
CID 106346848
5-amino-N-(6-chloro-2-pyridinyl)hexanamide
CID 82853086
(2R)-2-(3-chloroanilino)propanamide;hydrochloride
CID 164755970
2-(2-chloro-6-methylanilino)propanamide
CID 66252713
2-(4-chloroanilino)propanamide
CID 43085931
(2S)-2-(2,6-dimethylanilino)propanamide
CID 89462597
6-chloro-N-[1-(2H-tetrazol-5-yl)ethyl]pyridin-2-amine
CID 106194451

Frequently Asked Questions

What is the IUPAC name of 2-[(6-chloro-2-pyridinyl)amino]propanamide?
The IUPAC name of 2-[(6-chloro-2-pyridinyl)amino]propanamide (CID 63587646) is 2-[(6-chloro-2-pyridinyl)amino]propanamide.
What is the SMILES notation for 2-[(6-chloro-2-pyridinyl)amino]propanamide?
The canonical SMILES for 2-[(6-chloro-2-pyridinyl)amino]propanamide is CC(Nc1cccc(Cl)n1)C(N)=O.
What is the InChIKey of 2-[(6-chloro-2-pyridinyl)amino]propanamide?
The InChIKey is JFUYTHCBFWULTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3O/c1-5(8(10)13)11-7-4-2-3-6(9)12-7/h2-5H,1H3,(H2,10,13)(H,11,12).
What are the key properties of 2-[(6-chloro-2-pyridinyl)amino]propanamide?
2-[(6-chloro-2-pyridinyl)amino]propanamide has a molecular weight of 199.64 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-chloro-2-pyridinyl)amino]propanamide is sourced from PubChem (CID 63587646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).