2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide

C10H16N4O2S — CID 134416337

IUPAC2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide
SMILESCC(C)CC(N)C(=O)NS(=O)c1ncccn1
InChIInChI=1S/C10H16N4O2S/c1-7(2)6-8(11)9(15)14-17(16)10-12-4-3-5-13-10/h3-5,7-8H,6,11H2,1-2H3,(H,14,15)
InChIKeyJSNYLKLUTHHILK-UHFFFAOYSA-N
MW256.33 g/mol
LogP-0.01
Rot. Bonds5

About 2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide

2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide (PubChem CID 134416337) has the molecular formula C10H16N4O2S and a molecular weight of 256.33 g/mol. Its IUPAC name is 2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide.

Molecular Properties

Compound Name2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide
PubChem CID134416337
Molecular FormulaC10H16N4O2S
Molecular Weight256.33 g/mol
Exact Mass256.10
IUPAC Name2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide
SMILESCC(C)CC(N)C(=O)NS(=O)c1ncccn1
InChIInChI=1S/C10H16N4O2S/c1-7(2)6-8(11)9(15)14-17(16)10-12-4-3-5-13-10/h3-5,7-8H,6,11H2,1-2H3,(H,14,15)
InChIKeyJSNYLKLUTHHILK-UHFFFAOYSA-N
XLogP-0.01
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-2-amino-4-methyl-N-[(R)-phenylsulfinyl]pentanamide;(2S)-2-amino-4-methyl-N-[(S)-phenylsulfinyl]pentanamide
CID 158890382
2-amino-4-methyl-N-(3-pyridin-2-ylphenyl)sulfinylpentanamide
CID 134416326
2-amino-4-methyl-N-(3-methylphenyl)sulfinylpentanamide
CID 146353618
(2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide
CID 104903679
(2S)-2-amino-N-(1H-imidazol-2-yl)-4-methylpentanamide
CID 63562983
2-amino-N-(2-ethoxy-3-pyridinyl)-4-methylpentanamide
CID 43706630
(2S)-2-amino-N-(2-ethoxy-3-pyridinyl)-4-methylpentanamide
CID 61178380
(2S)-2-amino-4-methyl-N-[4-(pyridin-2-ylamino)butyl]pentanamide;dihydrochloride
CID 119874722
(2S)-2-amino-4-methyl-N-quinolin-6-ylpentanamide
CID 14310136
(2S)-2-amino-4-methyl-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]pentanamide
CID 119902328
(2R)-2-amino-4-methyl-N-(1,3-thiazol-2-ylmethyl)pentanamide
CID 104903307
(2R)-2-amino-N-hydroxy-4-methylpentanamide
CID 6951121

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide?
The IUPAC name of 2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide (CID 134416337) is 2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide.
What is the SMILES notation for 2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide?
The canonical SMILES for 2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide is CC(C)CC(N)C(=O)NS(=O)c1ncccn1.
What is the InChIKey of 2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide?
The InChIKey is JSNYLKLUTHHILK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2S/c1-7(2)6-8(11)9(15)14-17(16)10-12-4-3-5-13-10/h3-5,7-8H,6,11H2,1-2H3,(H,14,15).
What are the key properties of 2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide?
2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide has a molecular weight of 256.33 g/mol, XLogP of -0.01, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methyl-N-pyrimidin-2-ylsulfinylpentanamide is sourced from PubChem (CID 134416337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).