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

C24H30N6O2 — CID 10938987

IUPACN-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[6-methyl-3-[(2-methyl-2-phenylpropyl)amino]-2-oxopyrazin-1-yl]acetamide
SMILESCc1nc(N)ccc1CNC(=O)Cn1c(C)cnc(NCC(C)(C)c2ccccc2)c1=O
InChIInChI=1S/C24H30N6O2/c1-16-12-27-22(28-15-24(3,4)19-8-6-5-7-9-19)23(32)30(16)14-21(31)26-13-18-10-11-20(25)29-17(18)2/h5-12H,13-15H2,1-4H3,(H2,25,29)(H,26,31)(H,27,28)
InChIKeyYTDWOXUEZRXCIH-UHFFFAOYSA-N
MW434.54 g/mol
LogP2.54
Rot. Bonds8

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

N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[6-methyl-3-[(2-methyl-2-phenylpropyl)amino]-2-oxopyrazin-1-yl]acetamide (PubChem CID 10938987) has the molecular formula C24H30N6O2 and a molecular weight of 434.54 g/mol. Its IUPAC name is N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[6-methyl-3-[(2-methyl-2-phenylpropyl)amino]-2-oxopyrazin-1-yl]acetamide.

Molecular Properties

Compound NameN-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[6-methyl-3-[(2-methyl-2-phenylpropyl)amino]-2-oxopyrazin-1-yl]acetamide
PubChem CID10938987
Molecular FormulaC24H30N6O2
Molecular Weight434.54 g/mol
Exact Mass434.24
IUPAC NameN-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[6-methyl-3-[(2-methyl-2-phenylpropyl)amino]-2-oxopyrazin-1-yl]acetamide
SMILESCc1nc(N)ccc1CNC(=O)Cn1c(C)cnc(NCC(C)(C)c2ccccc2)c1=O
InChIInChI=1S/C24H30N6O2/c1-16-12-27-22(28-15-24(3,4)19-8-6-5-7-9-19)23(32)30(16)14-21(31)26-13-18-10-11-20(25)29-17(18)2/h5-12H,13-15H2,1-4H3,(H2,25,29)(H,26,31)(H,27,28)
InChIKeyYTDWOXUEZRXCIH-UHFFFAOYSA-N
XLogP2.54
TPSA114.93 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.54
LogP ≤ 52.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

L-374,087
CID 9911866
L-375378
CID 154118
N-(6-Amino-2,4-dimethyl-pyridin-3-ylmethyl)-2-(6-methyl-2-oxo-3-phenethylamino-2H-pyrazin-1-yl)-acetamide
CID 6426822
N-(6-Amino-2-methyl-pyridin-3-ylmethyl)-2-[6-methyl-2-oxo-3-(2-pyridin-3-yl-ethylamino)-2H-pyrazin-1-yl]-acetamide
CID 10884041
N-(6-Amino-2-methyl-pyridin-3-ylmethyl)-2-[6-methyl-2-oxo-3-(2-pyridin-2-yl-ethylamino)-2H-pyrazin-1-yl]-acetamide
CID 11004075
N-((6-amino-2-methylpyridin-3-yl)methyl)-2-(3-(2,2-difluoro-2-phenylethylamino)-6-methyl-2-oxopyrazin-1(2H)-yl)acetamide
CID 11762017
N-(6-Amino-2-methyl-pyridin-3-ylmethyl)-2-[6-methyl-3-((R)-1-methyl-2-phenyl-ethylamino)-2-oxo-2H-pyrazin-1-yl]-acetamide
CID 11796404
N-(6-Amino-2,4-dimethyl-pyridin-3-ylmethyl)-2-(6-methyl-2-oxo-3-phenylmethanesulfonylamino-2H-pyridin-1-yl)-acetamide
CID 44379905
N-[(6-carbamimidoylpyridin-3-yl)methyl]-2-{2-oxo-6-phenyl-3-[(2-phenylethyl)amino]-1,2-dihydropyrazin-1-yl}acetamide
CID 11762589
7Wvz3C3pmq
CID 9956947
N-(6-Amino-2-methyl-pyridin-3-ylmethyl)-2-((R)-3-isobutyl-3,6-dimethyl-2,8-dioxo-2,3,4,8-tetrahydro-1H-[1,7]naphthyridin-7-yl)-acetamide
CID 10387708
N-(6-Amino-2-methyl-pyridin-3-ylmethyl)-2-[3-(2,2-difluoro-2-pyridin-2-yl-ethylamino)-6-methyl-2-oxo-2H-pyrazin-1-yl]-acetamide
CID 11812296

Frequently Asked Questions

What is the IUPAC name of N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[6-methyl-3-[(2-methyl-2-phenylpropyl)amino]-2-oxopyrazin-1-yl]acetamide?
The IUPAC name of N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[6-methyl-3-[(2-methyl-2-phenylpropyl)amino]-2-oxopyrazin-1-yl]acetamide (CID 10938987) is N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[6-methyl-3-[(2-methyl-2-phenylpropyl)amino]-2-oxopyrazin-1-yl]acetamide.
What is the SMILES notation for N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[6-methyl-3-[(2-methyl-2-phenylpropyl)amino]-2-oxopyrazin-1-yl]acetamide?
The canonical SMILES for N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[6-methyl-3-[(2-methyl-2-phenylpropyl)amino]-2-oxopyrazin-1-yl]acetamide is Cc1nc(N)ccc1CNC(=O)Cn1c(C)cnc(NCC(C)(C)c2ccccc2)c1=O.
What is the InChIKey of N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[6-methyl-3-[(2-methyl-2-phenylpropyl)amino]-2-oxopyrazin-1-yl]acetamide?
The InChIKey is YTDWOXUEZRXCIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N6O2/c1-16-12-27-22(28-15-24(3,4)19-8-6-5-7-9-19)23(32)30(16)14-21(31)26-13-18-10-11-20(25)29-17(18)2/h5-12H,13-15H2,1-4H3,(H2,25,29)(H,26,31)(H,27,28).
What are the key properties of N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[6-methyl-3-[(2-methyl-2-phenylpropyl)amino]-2-oxopyrazin-1-yl]acetamide?
N-[(6-amino-2-methyl-3-pyridinyl)methyl]-2-[6-methyl-3-[(2-methyl-2-phenylpropyl)amino]-2-oxopyrazin-1-yl]acetamide has a molecular weight of 434.54 g/mol, XLogP of 2.54, 8 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-3-pyridinyl)methyl]-2-[6-methyl-3-[(2-methyl-2-phenylpropyl)amino]-2-oxopyrazin-1-yl]acetamide is sourced from PubChem (CID 10938987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).