(2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide

C9H13N3O — CID 61147752

IUPAC(2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide
SMILESCc1ccc(NC(=O)[C@H](C)N)nc1
InChIInChI=1S/C9H13N3O/c1-6-3-4-8(11-5-6)12-9(13)7(2)10/h3-5,7H,10H2,1-2H3,(H,11,12,13)/t7-/m0/s1
InChIKeyFJPHHTAXONNJMM-ZETCQYMHSA-N
MW179.22 g/mol
LogP0.68
Rot. Bonds2

About (2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide

(2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide (PubChem CID 61147752) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is (2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide
PubChem CID61147752
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name(2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide
SMILESCc1ccc(NC(=O)[C@H](C)N)nc1
InChIInChI=1S/C9H13N3O/c1-6-3-4-8(11-5-6)12-9(13)7(2)10/h3-5,7H,10H2,1-2H3,(H,11,12,13)/t7-/m0/s1
InChIKeyFJPHHTAXONNJMM-ZETCQYMHSA-N
XLogP0.68
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-(5-chloro-2-pyridinyl)propanamide
CID 61146165
(2R)-2-amino-N-(5-methyl-2-pyridinyl)-2-phenylacetamide
CID 61148111
(2S)-N-(5-methyl-2-pyridinyl)-2-methylsulfonylpropanamide
CID 94025050
2-amino-N-[5-(ethylamino)-2-pyridinyl]propanamide
CID 82034104
N,N'-bis(5-methyl-2-pyridinyl)-2-phenylpropanediamide
CID 3419355
N'-(5-methyl-2-pyridinyl)oxamide
CID 23087857
N-(5-methyl-2-pyridinyl)-2-(propan-2-ylamino)acetamide
CID 60841992
2-amino-N-[5-(N-ethyl-3-methylanilino)-2-pyridinyl]propanamide
CID 82034854
2-amino-2-(1-methylpyrazol-4-yl)-N-(5-methyl-2-pyridinyl)acetamide
CID 115289678
2-amino-5-methoxy-N-(5-methyl-2-pyridinyl)pentanamide
CID 81080952
(2S)-2-(2,3-dichlorophenoxy)-N-(5-methyl-2-pyridinyl)propanamide
CID 27233794
(2S)-2-amino-N-(5-bromo-4-methyl-2-pyridinyl)propanamide
CID 79734122

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide?
The IUPAC name of (2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide (CID 61147752) is (2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide.
What is the SMILES notation for (2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide?
The canonical SMILES for (2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide is Cc1ccc(NC(=O)[C@H](C)N)nc1.
What is the InChIKey of (2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide?
The InChIKey is FJPHHTAXONNJMM-ZETCQYMHSA-N. The full InChI is InChI=1S/C9H13N3O/c1-6-3-4-8(11-5-6)12-9(13)7(2)10/h3-5,7H,10H2,1-2H3,(H,11,12,13)/t7-/m0/s1.
What are the key properties of (2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide?
(2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide has a molecular weight of 179.22 g/mol, XLogP of 0.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(5-methyl-2-pyridinyl)propanamide is sourced from PubChem (CID 61147752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).