(3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide

C21H20ClN3O — CID 25375954

IUPAC(3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide
SMILESO=C(C[C@H](c1ccccc1)c1cccc(Cl)c1)NCCc1cnccn1
InChIInChI=1S/C21H20ClN3O/c22-18-8-4-7-17(13-18)20(16-5-2-1-3-6-16)14-21(26)25-10-9-19-15-23-11-12-24-19/h1-8,11-13,15,20H,9-10,14H2,(H,25,26)/t20-/m1/s1
InChIKeyNGBPJZPYDXJLMQ-HXUWFJFHSA-N
MW365.86 g/mol
LogP4.01
Rot. Bonds7

About (3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide

(3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide (PubChem CID 25375954) has the molecular formula C21H20ClN3O and a molecular weight of 365.86 g/mol. Its IUPAC name is (3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide.

Molecular Properties

Compound Name(3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide
PubChem CID25375954
Molecular FormulaC21H20ClN3O
Molecular Weight365.86 g/mol
Exact Mass365.13
IUPAC Name(3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide
SMILESO=C(C[C@H](c1ccccc1)c1cccc(Cl)c1)NCCc1cnccn1
InChIInChI=1S/C21H20ClN3O/c22-18-8-4-7-17(13-18)20(16-5-2-1-3-6-16)14-21(26)25-10-9-19-15-23-11-12-24-19/h1-8,11-13,15,20H,9-10,14H2,(H,25,26)/t20-/m1/s1
InChIKeyNGBPJZPYDXJLMQ-HXUWFJFHSA-N
XLogP4.01
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.86
LogP ≤ 54.01
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
(3S)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyridin-3-ylethyl)propanamide
CID 97283539
(3S)-3-(3-chlorophenyl)-3-phenyl-N-(pyrimidin-4-ylmethyl)propanamide
CID 25301507
3-(3-chlorophenyl)-3-(1H-indol-3-yl)-N-(2-pyridin-2-ylethyl)propanamide
CID 42774472
3-(3-chlorophenyl)-N-(2-methoxyethyl)-3-phenylpropanamide
CID 45193216
(3R)-3-(3-chlorophenyl)-N-[2-(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)ethyl]-3-phenylpropanamide
CID 97275845
3-(3-chlorophenyl)-3-(7-ethyl-1H-indol-3-yl)-N-(2-pyridin-2-ylethyl)propanamide
CID 42774604
(3S)-3-(3-chlorophenyl)-3-(3-hydroxyphenyl)-N-methyl-N-(pyrazin-2-ylmethyl)propanamide
CID 26395678
(3S)-3-(3-chlorophenyl)-3-(3-hydroxyphenyl)-N-(pyridin-3-ylmethyl)propanamide
CID 42533121
2-(4-phenylphenyl)-N-(2-pyrazin-2-ylethyl)acetamide
CID 29029737
N-[1-(3-chlorophenyl)ethyl]-4-(2-pyrazin-2-ylethyl)piperazine-1-carboxamide
CID 154780669
N-[2-(3-chlorophenyl)ethyl]-3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-phenylpropanamide
CID 110416583

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide?
The IUPAC name of (3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide (CID 25375954) is (3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide.
What is the SMILES notation for (3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide?
The canonical SMILES for (3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide is O=C(C[C@H](c1ccccc1)c1cccc(Cl)c1)NCCc1cnccn1.
What is the InChIKey of (3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide?
The InChIKey is NGBPJZPYDXJLMQ-HXUWFJFHSA-N. The full InChI is InChI=1S/C21H20ClN3O/c22-18-8-4-7-17(13-18)20(16-5-2-1-3-6-16)14-21(26)25-10-9-19-15-23-11-12-24-19/h1-8,11-13,15,20H,9-10,14H2,(H,25,26)/t20-/m1/s1.
What are the key properties of (3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide?
(3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide has a molecular weight of 365.86 g/mol, XLogP of 4.01, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(3-chlorophenyl)-3-phenyl-N-(2-pyrazin-2-ylethyl)propanamide is sourced from PubChem (CID 25375954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).