N-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide

C15H18N4O — CID 62762354

IUPACN-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide
SMILESCC(=O)N(C)Cc1cccc(NCc2cnccn2)c1
InChIInChI=1S/C15H18N4O/c1-12(20)19(2)11-13-4-3-5-14(8-13)18-10-15-9-16-6-7-17-15/h3-9,18H,10-11H2,1-2H3
InChIKeyLMNPCRSTYGNHEA-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.07
Rot. Bonds5

About N-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide

N-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide (PubChem CID 62762354) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is N-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide.

Molecular Properties

Compound NameN-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide
PubChem CID62762354
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC NameN-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide
SMILESCC(=O)N(C)Cc1cccc(NCc2cnccn2)c1
InChIInChI=1S/C15H18N4O/c1-12(20)19(2)11-13-4-3-5-14(8-13)18-10-15-9-16-6-7-17-15/h3-9,18H,10-11H2,1-2H3
InChIKeyLMNPCRSTYGNHEA-UHFFFAOYSA-N
XLogP2.07
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 62761310
N-[[3-[(2-fluorophenyl)methylamino]phenyl]methyl]-N-methylacetamide
CID 43433505
N-[[3-(3,3-dimethylbutylamino)phenyl]methyl]-N-methylacetamide
CID 62950211
N-[[3-[(5-iodofuran-2-yl)methylamino]phenyl]methyl]-N-methylacetamide
CID 43786918
N-(pyrazin-2-ylmethyl)-3-pyrrol-1-ylaniline
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N-methyl-N-[[3-(3-methylbutan-2-ylamino)phenyl]methyl]acetamide
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1-N-ethyl-4-N-(pyrazin-2-ylmethyl)benzene-1,4-diamine
CID 83962412
3-imidazol-1-yl-N-(pyrazin-2-ylmethyl)aniline
CID 55110075
N-[3-[[acetyl(methyl)amino]methyl]phenyl]-3-bromopropanamide
CID 113385188
N-[[3-(3,4-dihydro-2H-pyran-2-ylmethylamino)phenyl]methyl]-N-methylacetamide
CID 62066923
N-[3-[[acetyl(methyl)amino]methyl]phenyl]-5-chloropentanamide
CID 43699890
N-methyl-N-[[3-[(1-methylpiperidin-4-yl)methylamino]phenyl]methyl]acetamide
CID 62659590

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide?
The IUPAC name of N-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide (CID 62762354) is N-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide.
What is the SMILES notation for N-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide?
The canonical SMILES for N-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide is CC(=O)N(C)Cc1cccc(NCc2cnccn2)c1.
What is the InChIKey of N-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide?
The InChIKey is LMNPCRSTYGNHEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-12(20)19(2)11-13-4-3-5-14(8-13)18-10-15-9-16-6-7-17-15/h3-9,18H,10-11H2,1-2H3.
What are the key properties of N-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide?
N-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide has a molecular weight of 270.34 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[3-(pyrazin-2-ylmethylamino)phenyl]methyl]acetamide is sourced from PubChem (CID 62762354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).