(2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide

C10H14ClN3O — CID 107570362

IUPAC(2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide
SMILESCCC[C@H](N)C(=O)Nc1cccc(Cl)n1
InChIInChI=1S/C10H14ClN3O/c1-2-4-7(12)10(15)14-9-6-3-5-8(11)13-9/h3,5-7H,2,4,12H2,1H3,(H,13,14,15)/t7-/m0/s1
InChIKeyAISFCNOBLFPBQI-ZETCQYMHSA-N
MW227.69 g/mol
LogP1.80
Rot. Bonds4

About (2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide

(2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide (PubChem CID 107570362) has the molecular formula C10H14ClN3O and a molecular weight of 227.69 g/mol. Its IUPAC name is (2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide
PubChem CID107570362
Molecular FormulaC10H14ClN3O
Molecular Weight227.69 g/mol
Exact Mass227.08
IUPAC Name(2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide
SMILESCCC[C@H](N)C(=O)Nc1cccc(Cl)n1
InChIInChI=1S/C10H14ClN3O/c1-2-4-7(12)10(15)14-9-6-3-5-8(11)13-9/h3,5-7H,2,4,12H2,1H3,(H,13,14,15)/t7-/m0/s1
InChIKeyAISFCNOBLFPBQI-ZETCQYMHSA-N
XLogP1.80
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.69
LogP ≤ 51.80
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-chloro-2-pyridinyl)hexanamide
CID 82853086
2-amino-N-(2-chloro-6-methylphenyl)pentanamide
CID 66254750
(2R)-2-amino-N-(4-chlorophenyl)pentanamide
CID 93255469
(2R)-2-amino-N-(2-chloro-6-fluorophenyl)pentanamide
CID 107570747
2-amino-N-(6-bromo-2-pyridinyl)butanamide;hydrochloride
CID 126623961
N-(6-chloro-2-pyridinyl)-2-methoxy-2-phenylacetamide
CID 115683268
N-(6-chloro-2-pyridinyl)-2-propoxyacetamide
CID 103739833
(2S)-2-amino-N-(1-methylpyrazol-3-yl)pentanamide
CID 93313980
(2S)-2-amino-N-(2,6-dichloro-4-methyl-3-pyridinyl)pentanamide
CID 114051376
(2R)-2-amino-N-quinolin-8-ylpentanamide
CID 103813268
(2R)-2-amino-N-[3-chloro-2-(dimethylamino)phenyl]pentanamide
CID 103813583
(2S)-2-amino-N-(6-fluoro-2-pyridinyl)-4-methylsulfanylbutanamide
CID 104893696

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide?
The IUPAC name of (2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide (CID 107570362) is (2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide.
What is the SMILES notation for (2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide?
The canonical SMILES for (2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide is CCC[C@H](N)C(=O)Nc1cccc(Cl)n1.
What is the InChIKey of (2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide?
The InChIKey is AISFCNOBLFPBQI-ZETCQYMHSA-N. The full InChI is InChI=1S/C10H14ClN3O/c1-2-4-7(12)10(15)14-9-6-3-5-8(11)13-9/h3,5-7H,2,4,12H2,1H3,(H,13,14,15)/t7-/m0/s1.
What are the key properties of (2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide?
(2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide has a molecular weight of 227.69 g/mol, XLogP of 1.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(6-chloro-2-pyridinyl)pentanamide is sourced from PubChem (CID 107570362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).