N-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide

C19H28N6O2 — CID 57239297

IUPACN-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide
SMILESCC[C@H](C)CNc1ncc(C)n(-c2cc(CNC(C)=O)c(C)nc2N)c1=O
InChIInChI=1S/C19H28N6O2/c1-6-11(2)8-22-18-19(27)25(12(3)9-23-18)16-7-15(10-21-14(5)26)13(4)24-17(16)20/h7,9,11H,6,8,10H2,1-5H3,(H2,20,24)(H,21,26)(H,22,23)/t11-/m0/s1
InChIKeyOPGOJUSLISVZFV-NSHDSACASA-N
MW372.47 g/mol
LogP1.92
Rot. Bonds7

About N-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide

N-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide (PubChem CID 57239297) has the molecular formula C19H28N6O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is N-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide
PubChem CID57239297
Molecular FormulaC19H28N6O2
Molecular Weight372.47 g/mol
Exact Mass372.23
IUPAC NameN-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide
SMILESCC[C@H](C)CNc1ncc(C)n(-c2cc(CNC(C)=O)c(C)nc2N)c1=O
InChIInChI=1S/C19H28N6O2/c1-6-11(2)8-22-18-19(27)25(12(3)9-23-18)16-7-15(10-21-14(5)26)13(4)24-17(16)20/h7,9,11H,6,8,10H2,1-5H3,(H2,20,24)(H,21,26)(H,22,23)/t11-/m0/s1
InChIKeyOPGOJUSLISVZFV-NSHDSACASA-N
XLogP1.92
TPSA114.93 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 51.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze N-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide?
The IUPAC name of N-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide (CID 57239297) is N-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide.
What is the SMILES notation for N-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide?
The canonical SMILES for N-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide is CC[C@H](C)CNc1ncc(C)n(-c2cc(CNC(C)=O)c(C)nc2N)c1=O.
What is the InChIKey of N-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide?
The InChIKey is OPGOJUSLISVZFV-NSHDSACASA-N. The full InChI is InChI=1S/C19H28N6O2/c1-6-11(2)8-22-18-19(27)25(12(3)9-23-18)16-7-15(10-21-14(5)26)13(4)24-17(16)20/h7,9,11H,6,8,10H2,1-5H3,(H2,20,24)(H,21,26)(H,22,23)/t11-/m0/s1.
What are the key properties of N-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide?
N-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide has a molecular weight of 372.47 g/mol, XLogP of 1.92, 7 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-amino-2-methyl-5-[6-methyl-3-[[(2S)-2-methylbutyl]amino]-2-oxopyrazin-1-yl]-3-pyridinyl]methyl]acetamide is sourced from PubChem (CID 57239297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).