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

C18H24N6O2 — CID 54179783

IUPACN-[[6-amino-5-[3-(cyclopropylmethylamino)-6-methyl-2-oxopyrazin-1-yl]-2-methyl-3-pyridinyl]methyl]acetamide
SMILESCC(=O)NCc1cc(-n2c(C)cnc(NCC3CC3)c2=O)c(N)nc1C
InChIInChI=1S/C18H24N6O2/c1-10-7-21-17(22-8-13-4-5-13)18(26)24(10)15-6-14(9-20-12(3)25)11(2)23-16(15)19/h6-7,13H,4-5,8-9H2,1-3H3,(H2,19,23)(H,20,25)(H,21,22)
InChIKeyPAZQFNVZXUEUTG-UHFFFAOYSA-N
MW356.43 g/mol
LogP1.28
Rot. Bonds6

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

N-[[6-amino-5-[3-(cyclopropylmethylamino)-6-methyl-2-oxopyrazin-1-yl]-2-methyl-3-pyridinyl]methyl]acetamide (PubChem CID 54179783) has the molecular formula C18H24N6O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is N-[[6-amino-5-[3-(cyclopropylmethylamino)-6-methyl-2-oxopyrazin-1-yl]-2-methyl-3-pyridinyl]methyl]acetamide.

Molecular Properties

Compound NameN-[[6-amino-5-[3-(cyclopropylmethylamino)-6-methyl-2-oxopyrazin-1-yl]-2-methyl-3-pyridinyl]methyl]acetamide
PubChem CID54179783
Molecular FormulaC18H24N6O2
Molecular Weight356.43 g/mol
Exact Mass356.20
IUPAC NameN-[[6-amino-5-[3-(cyclopropylmethylamino)-6-methyl-2-oxopyrazin-1-yl]-2-methyl-3-pyridinyl]methyl]acetamide
SMILESCC(=O)NCc1cc(-n2c(C)cnc(NCC3CC3)c2=O)c(N)nc1C
InChIInChI=1S/C18H24N6O2/c1-10-7-21-17(22-8-13-4-5-13)18(26)24(10)15-6-14(9-20-12(3)25)11(2)23-16(15)19/h6-7,13H,4-5,8-9H2,1-3H3,(H2,19,23)(H,20,25)(H,21,22)
InChIKeyPAZQFNVZXUEUTG-UHFFFAOYSA-N
XLogP1.28
TPSA114.93 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 51.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[[6-amino-5-[3-(cyclopropylmethylamino)-6-methyl-2-oxopyrazin-1-yl]-2-methyl-3-pyridinyl]methyl]acetamide?
The IUPAC name of N-[[6-amino-5-[3-(cyclopropylmethylamino)-6-methyl-2-oxopyrazin-1-yl]-2-methyl-3-pyridinyl]methyl]acetamide (CID 54179783) is N-[[6-amino-5-[3-(cyclopropylmethylamino)-6-methyl-2-oxopyrazin-1-yl]-2-methyl-3-pyridinyl]methyl]acetamide.
What is the SMILES notation for N-[[6-amino-5-[3-(cyclopropylmethylamino)-6-methyl-2-oxopyrazin-1-yl]-2-methyl-3-pyridinyl]methyl]acetamide?
The canonical SMILES for N-[[6-amino-5-[3-(cyclopropylmethylamino)-6-methyl-2-oxopyrazin-1-yl]-2-methyl-3-pyridinyl]methyl]acetamide is CC(=O)NCc1cc(-n2c(C)cnc(NCC3CC3)c2=O)c(N)nc1C.
What is the InChIKey of N-[[6-amino-5-[3-(cyclopropylmethylamino)-6-methyl-2-oxopyrazin-1-yl]-2-methyl-3-pyridinyl]methyl]acetamide?
The InChIKey is PAZQFNVZXUEUTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O2/c1-10-7-21-17(22-8-13-4-5-13)18(26)24(10)15-6-14(9-20-12(3)25)11(2)23-16(15)19/h6-7,13H,4-5,8-9H2,1-3H3,(H2,19,23)(H,20,25)(H,21,22).
What are the key properties of N-[[6-amino-5-[3-(cyclopropylmethylamino)-6-methyl-2-oxopyrazin-1-yl]-2-methyl-3-pyridinyl]methyl]acetamide?
N-[[6-amino-5-[3-(cyclopropylmethylamino)-6-methyl-2-oxopyrazin-1-yl]-2-methyl-3-pyridinyl]methyl]acetamide has a molecular weight of 356.43 g/mol, XLogP of 1.28, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-amino-5-[3-(cyclopropylmethylamino)-6-methyl-2-oxopyrazin-1-yl]-2-methyl-3-pyridinyl]methyl]acetamide is sourced from PubChem (CID 54179783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).