4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid

C13H17N5O2 — CID 122062606

IUPAC4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid
SMILESCC(C)CC(Nc1cncc(-n2cccn2)n1)C(=O)O
InChIInChI=1S/C13H17N5O2/c1-9(2)6-10(13(19)20)16-11-7-14-8-12(17-11)18-5-3-4-15-18/h3-5,7-10H,6H2,1-2H3,(H,16,17)(H,19,20)
InChIKeyPRMZIXJOHAMKPX-UHFFFAOYSA-N
MW275.31 g/mol
LogP1.57
Rot. Bonds6

About 4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid

4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid (PubChem CID 122062606) has the molecular formula C13H17N5O2 and a molecular weight of 275.31 g/mol. Its IUPAC name is 4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid.

Molecular Properties

Compound Name4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid
PubChem CID122062606
Molecular FormulaC13H17N5O2
Molecular Weight275.31 g/mol
Exact Mass275.14
IUPAC Name4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid
SMILESCC(C)CC(Nc1cncc(-n2cccn2)n1)C(=O)O
InChIInChI=1S/C13H17N5O2/c1-9(2)6-10(13(19)20)16-11-7-14-8-12(17-11)18-5-3-4-15-18/h3-5,7-10H,6H2,1-2H3,(H,16,17)(H,19,20)
InChIKeyPRMZIXJOHAMKPX-UHFFFAOYSA-N
XLogP1.57
TPSA92.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-4-methyl-2-[(6-methylsulfanylpyrazin-2-yl)amino]pentanoic acid
CID 122050109
(2S,4S)-2-methyl-4-[(6-pyrazol-1-ylpyrazin-2-yl)amino]hexan-1-ol
CID 95783013
(2R)-2-[[6-(2-hydroxyethoxy)pyrazin-2-yl]amino]-4-methylpentanoic acid
CID 122049228
N-[4-(furan-2-yl)butan-2-yl]-6-pyrazol-1-ylpyrazin-2-amine
CID 71940133
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-6-pyrazol-1-ylpyrazin-2-amine
CID 97020614
N-[2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]ethyl]methanesulfonamide
CID 51086656
N-methyl-2-[4-[[(6-pyrazol-1-ylpyrazin-2-yl)amino]methyl]phenoxy]acetamide
CID 47054790
(2R)-4-methyl-2-(3-pyrazol-1-ylpropanoylamino)pentanoic acid
CID 28788895
(2S)-2-[(2-benzylpyrimidin-4-yl)amino]-4-methylpentanoic acid
CID 122050124
(2S)-2-[(5-fluoro-2-pyridinyl)amino]-4-methylpentanoic acid
CID 120964579
2-[(6-ethoxy-2-methylpyrimidin-4-yl)amino]-4-methylpentanoic acid
CID 66331276
(2S)-2-[(2-cyclopropylpyrimidin-4-yl)amino]-4-methylpentanoic acid
CID 122050186

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid?
The IUPAC name of 4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid (CID 122062606) is 4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid.
What is the SMILES notation for 4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid?
The canonical SMILES for 4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid is CC(C)CC(Nc1cncc(-n2cccn2)n1)C(=O)O.
What is the InChIKey of 4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid?
The InChIKey is PRMZIXJOHAMKPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O2/c1-9(2)6-10(13(19)20)16-11-7-14-8-12(17-11)18-5-3-4-15-18/h3-5,7-10H,6H2,1-2H3,(H,16,17)(H,19,20).
What are the key properties of 4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid?
4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid has a molecular weight of 275.31 g/mol, XLogP of 1.57, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[(6-pyrazol-1-ylpyrazin-2-yl)amino]pentanoic acid is sourced from PubChem (CID 122062606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).