N-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide

C19H16ClN3O — CID 119052114

IUPACN-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide
SMILESO=C(Cc1cnccn1)NC(c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C19H16ClN3O/c20-16-8-6-15(7-9-16)19(14-4-2-1-3-5-14)23-18(24)12-17-13-21-10-11-22-17/h1-11,13,19H,12H2,(H,23,24)
InChIKeyPZLFPJNYTDEQFZ-UHFFFAOYSA-N
MW337.81 g/mol
LogP3.58
Rot. Bonds5

About N-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide

N-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide (PubChem CID 119052114) has the molecular formula C19H16ClN3O and a molecular weight of 337.81 g/mol. Its IUPAC name is N-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide
PubChem CID119052114
Molecular FormulaC19H16ClN3O
Molecular Weight337.81 g/mol
Exact Mass337.10
IUPAC NameN-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide
SMILESO=C(Cc1cnccn1)NC(c1ccccc1)c1ccc(Cl)cc1
InChIInChI=1S/C19H16ClN3O/c20-16-8-6-15(7-9-16)19(14-4-2-1-3-5-14)23-18(24)12-17-13-21-10-11-22-17/h1-11,13,19H,12H2,(H,23,24)
InChIKeyPZLFPJNYTDEQFZ-UHFFFAOYSA-N
XLogP3.58
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.81
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide
CID 45195362
2-chloro-N-[(S)-(4-chlorophenyl)-phenylmethyl]acetamide
CID 2466705
N-benzhydryl-2-[5-(4-chlorophenyl)-1,2-oxazol-3-yl]acetamide
CID 16878618
N-[(4-chlorophenyl)-pyridin-3-ylmethyl]-2-(4-methylphenoxy)acetamide
CID 20897097
N-[(4-chlorophenyl)-phenylmethyl]-2-[methyl(pyridin-3-ylsulfonyl)amino]acetamide
CID 55668921
2-(4-chlorophenoxy)-N-[(R)-(4-methylphenyl)-phenylmethyl]acetamide
CID 99950620
2-(4-chlorophenoxy)-N-[(4-methylphenyl)-phenylmethyl]acetamide
CID 132762003
N-[(R)-(4-chlorophenyl)-phenylmethyl]-2-(3-cyanophenoxy)acetamide
CID 8852910
2-(4-chlorophenyl)-N-[(3,4-dimethylphenyl)-pyridin-3-ylmethyl]acetamide
CID 20897057
N-[(R)-(4-chlorophenyl)-phenylmethyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 41088769
phenyl N-[(4-chlorophenyl)-phenylmethyl]carbamate
CID 101077414
N-[(4-chlorophenyl)-phenylmethyl]-2-naphthalen-2-yloxyacetamide
CID 2944649

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide?
The IUPAC name of N-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide (CID 119052114) is N-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide.
What is the SMILES notation for N-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide?
The canonical SMILES for N-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide is O=C(Cc1cnccn1)NC(c1ccccc1)c1ccc(Cl)cc1.
What is the InChIKey of N-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide?
The InChIKey is PZLFPJNYTDEQFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3O/c20-16-8-6-15(7-9-16)19(14-4-2-1-3-5-14)23-18(24)12-17-13-21-10-11-22-17/h1-11,13,19H,12H2,(H,23,24).
What are the key properties of N-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide?
N-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide has a molecular weight of 337.81 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)-phenylmethyl]-2-pyrazin-2-ylacetamide is sourced from PubChem (CID 119052114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).