5-amino-N-(6-chloro-2-pyridinyl)hexanamide

C11H16ClN3O — CID 82853086

IUPAC5-amino-N-(6-chloro-2-pyridinyl)hexanamide
SMILESCC(N)CCCC(=O)Nc1cccc(Cl)n1
InChIInChI=1S/C11H16ClN3O/c1-8(13)4-2-7-11(16)15-10-6-3-5-9(12)14-10/h3,5-6,8H,2,4,7,13H2,1H3,(H,14,15,16)
InChIKeyNURVKYQFYGZEOB-UHFFFAOYSA-N
MW241.72 g/mol
LogP2.19
Rot. Bonds5

About 5-amino-N-(6-chloro-2-pyridinyl)hexanamide

5-amino-N-(6-chloro-2-pyridinyl)hexanamide (PubChem CID 82853086) has the molecular formula C11H16ClN3O and a molecular weight of 241.72 g/mol. Its IUPAC name is 5-amino-N-(6-chloro-2-pyridinyl)hexanamide.

Molecular Properties

Compound Name5-amino-N-(6-chloro-2-pyridinyl)hexanamide
PubChem CID82853086
Molecular FormulaC11H16ClN3O
Molecular Weight241.72 g/mol
Exact Mass241.10
IUPAC Name5-amino-N-(6-chloro-2-pyridinyl)hexanamide
SMILESCC(N)CCCC(=O)Nc1cccc(Cl)n1
InChIInChI=1S/C11H16ClN3O/c1-8(13)4-2-7-11(16)15-10-6-3-5-9(12)14-10/h3,5-6,8H,2,4,7,13H2,1H3,(H,14,15,16)
InChIKeyNURVKYQFYGZEOB-UHFFFAOYSA-N
XLogP2.19
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 52.19
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

5-amino-N-(6-methyl-2-pyridinyl)hexanamide
CID 82849039
5-amino-N-(3-chlorophenyl)hexanamide
CID 82849187
(2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide
CID 107570362
N-(6-chloro-2-pyridinyl)-4,4,4-trifluorobutanamide
CID 115683234
N-(6-chloro-2-pyridinyl)-3,3-dimethylbutanamide
CID 115669489
5-amino-N-[4-(carbamoylamino)phenyl]hexanamide
CID 82848160
5-amino-N-[3-(2-methylpropanoylamino)phenyl]hexanamide
CID 82850255
5-amino-N-(2-hydroxy-3-methylphenyl)hexanamide
CID 82851221
5-amino-N-(2-bromophenyl)hexanamide
CID 82848124
5-amino-N-(2-iodophenyl)hexanamide
CID 82848467
N-(6-chloro-2-pyridinyl)-3-(2,2-difluoroethoxy)propanamide
CID 103213848
5-amino-N-(4-pyrazol-1-ylphenyl)hexanamide
CID 82848976

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(6-chloro-2-pyridinyl)hexanamide?
The IUPAC name of 5-amino-N-(6-chloro-2-pyridinyl)hexanamide (CID 82853086) is 5-amino-N-(6-chloro-2-pyridinyl)hexanamide.
What is the SMILES notation for 5-amino-N-(6-chloro-2-pyridinyl)hexanamide?
The canonical SMILES for 5-amino-N-(6-chloro-2-pyridinyl)hexanamide is CC(N)CCCC(=O)Nc1cccc(Cl)n1.
What is the InChIKey of 5-amino-N-(6-chloro-2-pyridinyl)hexanamide?
The InChIKey is NURVKYQFYGZEOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClN3O/c1-8(13)4-2-7-11(16)15-10-6-3-5-9(12)14-10/h3,5-6,8H,2,4,7,13H2,1H3,(H,14,15,16).
What are the key properties of 5-amino-N-(6-chloro-2-pyridinyl)hexanamide?
5-amino-N-(6-chloro-2-pyridinyl)hexanamide has a molecular weight of 241.72 g/mol, XLogP of 2.19, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(6-chloro-2-pyridinyl)hexanamide is sourced from PubChem (CID 82853086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).