N-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide

C18H17N3O — CID 171090606

IUPACN-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide
SMILESCc1cnc(CNC(=O)Cc2ccc3ccccc3c2)cn1
InChIInChI=1S/C18H17N3O/c1-13-10-20-17(11-19-13)12-21-18(22)9-14-6-7-15-4-2-3-5-16(15)8-14/h2-8,10-11H,9,12H2,1H3,(H,21,22)
InChIKeyRMUCLNBKARAIRV-UHFFFAOYSA-N
MW291.35 g/mol
LogP2.80
Rot. Bonds4

About N-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide

N-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide (PubChem CID 171090606) has the molecular formula C18H17N3O and a molecular weight of 291.35 g/mol. Its IUPAC name is N-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide.

Molecular Properties

Compound NameN-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide
PubChem CID171090606
Molecular FormulaC18H17N3O
Molecular Weight291.35 g/mol
Exact Mass291.14
IUPAC NameN-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide
SMILESCc1cnc(CNC(=O)Cc2ccc3ccccc3c2)cn1
InChIInChI=1S/C18H17N3O/c1-13-10-20-17(11-19-13)12-21-18(22)9-14-6-7-15-4-2-3-5-16(15)8-14/h2-8,10-11H,9,12H2,1H3,(H,21,22)
InChIKeyRMUCLNBKARAIRV-UHFFFAOYSA-N
XLogP2.80
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-chloropyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide
CID 171090409
N-[(4-tert-butylphenyl)methyl]-2-naphthalen-2-ylacetamide
CID 68703244
N-[(5-methylpyrazin-2-yl)methyl]-1H-indole-6-carboxamide
CID 63770378
N-[(2-methoxy-4-pyridinyl)methyl]-2-naphthalen-2-ylacetamide
CID 18167281
(3R)-3-(4-methoxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]-3-phenylpropanamide
CID 25375332
N-[(2-fluorophenyl)methyl]-2-naphthalen-2-ylacetamide
CID 8870478
3-methyl-N-[(5-methylpyrazin-2-yl)methyl]benzamide
CID 23530641
2-methoxy-N-[(5-methylpyrazin-2-yl)methyl]acetamide
CID 64590585
N-[[4-(1-aminoethyl)phenyl]methyl]-2-naphthalen-2-ylacetamide
CID 155821496
N-[(2R)-2-hydroxypropyl]-2-naphthalen-2-ylacetamide
CID 83032079
(5-methylpyrazin-2-yl)methylurea
CID 62845946
N-(2-bromoethyl)-2-naphthalen-2-ylacetamide
CID 43133408

Frequently Asked Questions

What is the IUPAC name of N-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide?
The IUPAC name of N-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide (CID 171090606) is N-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide.
What is the SMILES notation for N-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide?
The canonical SMILES for N-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide is Cc1cnc(CNC(=O)Cc2ccc3ccccc3c2)cn1.
What is the InChIKey of N-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide?
The InChIKey is RMUCLNBKARAIRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O/c1-13-10-20-17(11-19-13)12-21-18(22)9-14-6-7-15-4-2-3-5-16(15)8-14/h2-8,10-11H,9,12H2,1H3,(H,21,22).
What are the key properties of N-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide?
N-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide has a molecular weight of 291.35 g/mol, XLogP of 2.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methylpyrazin-2-yl)methyl]-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 171090606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).